Organic oxoazanium compounds

Organic compounds that contain or are associated with an oxoazanium ion; oxoazanium ions have an oxygen atom bonded to a nitrogen atom via a double bond, and the nitrogen atom is bonded to two hydrogen atoms.

1 – 15 of 144 results

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4-Nitrophenyl chloroformate, 97%

CAS: 7693-46-1 Molecular Formula: C₇H₄ClNO₄ Molecular Weight (g/mol): 201.57 MDL Number: MFCD00007321 InChI Key: NXLNNXIXOYSCMB-UHFFFAOYSA-N Synonym: 4-nitrophenyl chloroformate,carbonochloridic acid, 4-nitrophenyl ester,chloroformic acid 4-nitrophenyl ester,p-nitrophenyl chloroformate,chloroformic acid p-nitrophenyl ester,4-nitrophenyl carbonochloridate,formic acid, chloro-, p-nitrophenyl ester,4-nitrophenylchlorocarbonat,4-nitrophenyl choroformate PubChem CID: 82129 IUPAC Name: (4-nitrophenyl) carbonochloridate SMILES: C1=CC(=CC=C1[N+](=O)[O-])OC(=O)Cl

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PubChem CID	82129
CAS	7693-46-1
Molecular Weight (g/mol)	201.57
MDL Number	MFCD00007321
SMILES	C1=CC(=CC=C1[N+](=O)[O-])OC(=O)Cl
Synonym	4-nitrophenyl chloroformate,carbonochloridic acid, 4-nitrophenyl ester,chloroformic acid 4-nitrophenyl ester,p-nitrophenyl chloroformate,chloroformic acid p-nitrophenyl ester,4-nitrophenyl carbonochloridate,formic acid, chloro-, p-nitrophenyl ester,4-nitrophenylchlorocarbonat,4-nitrophenyl choroformate
IUPAC Name	(4-nitrophenyl) carbonochloridate
InChI Key	NXLNNXIXOYSCMB-UHFFFAOYSA-N
Molecular Formula	C₇H₄ClNO₄

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2,4-Dinitrofluorobenzene, 98%

CAS: 70-34-8 Molecular Formula: C₆H₃FN₂O₄ Molecular Weight (g/mol): 186.1 MDL Number: MFCD00007056 InChI Key: LOTKRQAVGJMPNV-UHFFFAOYSA-N Synonym: 2,4-dinitrofluorobenzene,dinitrofluorobenzene,fdnb,dnfb,2,4-dinitro-1-fluorobenzene,sanger's reagent,fluoro-2,4-dinitrobenzene,2,4-dinitrobenzenefluoride,2,4-dinitrophenyl fluoride,fluorodinitrobenzene PubChem CID: 6264 ChEBI: CHEBI:53049 IUPAC Name: 1-fluoro-2,4-dinitrobenzene SMILES: C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])F

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Specifications

PubChem CID	6264
CAS	70-34-8
Molecular Weight (g/mol)	186.1
ChEBI	CHEBI:53049
MDL Number	MFCD00007056
SMILES	C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])F
Synonym	2,4-dinitrofluorobenzene,dinitrofluorobenzene,fdnb,dnfb,2,4-dinitro-1-fluorobenzene,sanger's reagent,fluoro-2,4-dinitrobenzene,2,4-dinitrobenzenefluoride,2,4-dinitrophenyl fluoride,fluorodinitrobenzene
IUPAC Name	1-fluoro-2,4-dinitrobenzene
InChI Key	LOTKRQAVGJMPNV-UHFFFAOYSA-N
Molecular Formula	C₆H₃FN₂O₄

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4-(4-Nitrobenzyl)pyridine, 98%

CAS: 1083-48-3 Molecular Formula: C12H10N2O2 Molecular Weight (g/mol): 214.22 MDL Number: MFCD00006445 InChI Key: MNHKUCBXXMFQDM-UHFFFAOYSA-N Synonym: 4-4-nitrobenzyl pyridine,4-4-nitrophenyl methyl pyridine,pyridine, 4-4-nitrophenyl methyl,pyridine, 4-p-nitrobenzyl,1-p-nitrobenzyl pyridine,4-p-nitrobenzyl pyridine,4 4-nitrobenzyl primide,unii-0z6gs37n7h,gamma-p-nitrobenzyl pyridine PubChem CID: 14129 IUPAC Name: 4-[(4-nitrophenyl)methyl]pyridine SMILES: [O-][N+](=O)C1=CC=C(CC2=CC=NC=C2)C=C1

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PubChem CID	14129
CAS	1083-48-3
Molecular Weight (g/mol)	214.22
MDL Number	MFCD00006445
SMILES	[O-][N+](=O)C1=CC=C(CC2=CC=NC=C2)C=C1
Synonym	4-4-nitrobenzyl pyridine,4-4-nitrophenyl methyl pyridine,pyridine, 4-4-nitrophenyl methyl,pyridine, 4-p-nitrobenzyl,1-p-nitrobenzyl pyridine,4-p-nitrobenzyl pyridine,4 4-nitrobenzyl primide,unii-0z6gs37n7h,gamma-p-nitrobenzyl pyridine
IUPAC Name	4-[(4-nitrophenyl)methyl]pyridine
InChI Key	MNHKUCBXXMFQDM-UHFFFAOYSA-N
Molecular Formula	C12H10N2O2

Nitromethane, 99%, pure

CAS: 75-52-5 Molecular Formula: CH3NO2 Molecular Weight (g/mol): 61.04 MDL Number: MFCD00007400 InChI Key: LYGJENNIWJXYER-UHFFFAOYSA-N Synonym: methane, nitro,nitrocarbol,nitrometan,nitrometan polish,nitro-methane,unii-ru5wg8c3f4,ccris 1205,hsdb 106,meno2,ru5wg8c3f4 PubChem CID: 6375 ChEBI: CHEBI:77701 IUPAC Name: nitromethane SMILES: C[N+]([O-])=O

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PubChem CID	6375
CAS	75-52-5
Molecular Weight (g/mol)	61.04
ChEBI	CHEBI:77701
MDL Number	MFCD00007400
SMILES	C[N+]([O-])=O
Synonym	methane, nitro,nitrocarbol,nitrometan,nitrometan polish,nitro-methane,unii-ru5wg8c3f4,ccris 1205,hsdb 106,meno2,ru5wg8c3f4
IUPAC Name	nitromethane
InChI Key	LYGJENNIWJXYER-UHFFFAOYSA-N
Molecular Formula	CH3NO2

4-Nitrobenzenediazonium tetrafluoroborate, 97%

CAS: 456-27-9 Molecular Formula: C6H4BF4N3O2 Molecular Weight (g/mol): 236.92 MDL Number: MFCD00012005 InChI Key: AFULQCYCQAHYIP-UHFFFAOYSA-N Synonym: 4-nitrobenzenediazonium tetrafluoroborate,ccris 3641,unii-2uxo615r4o,p-nitrobenzenediazonium tetrafluoroborate,benzenediazonium, 4-nitro-, tetrafluoroborate 1-,p-nitrophenyldiazonium fluoborate,p-nitrobenzenediazonium fluoborate,4-nitrobenzenediazonium fluoborate,p-nitrobenzenediazonium fluoroborate,4-nitrobenzenediazonium fluoroborate PubChem CID: 68006 IUPAC Name: 4-nitrobenzenediazonium;tetrafluoroborate SMILES: F[B-](F)(F)F.[O-][N+](=O)C1=CC=C(C=C1)[N+]#N

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Specifications

PubChem CID	68006
CAS	456-27-9
Molecular Weight (g/mol)	236.92
MDL Number	MFCD00012005
SMILES	F[B-](F)(F)F.[O-][N+](=O)C1=CC=C(C=C1)[N+]#N
Synonym	4-nitrobenzenediazonium tetrafluoroborate,ccris 3641,unii-2uxo615r4o,p-nitrobenzenediazonium tetrafluoroborate,benzenediazonium, 4-nitro-, tetrafluoroborate 1-,p-nitrophenyldiazonium fluoborate,p-nitrobenzenediazonium fluoborate,4-nitrobenzenediazonium fluoborate,p-nitrobenzenediazonium fluoroborate,4-nitrobenzenediazonium fluoroborate
IUPAC Name	4-nitrobenzenediazonium;tetrafluoroborate
InChI Key	AFULQCYCQAHYIP-UHFFFAOYSA-N
Molecular Formula	C6H4BF4N3O2

4-Fluoro-2-nitrobenzonitrile, 97%

CAS: 80517-21-1 Molecular Formula: C7H3FN2O2 Molecular Weight (g/mol): 166.111 MDL Number: MFCD00277447 InChI Key: MNEAKKQYFSYZEU-UHFFFAOYSA-N Synonym: 2-cyano-5-fluoronitrobenzene,benzonitrile, 4-fluoro-2-nitro,buttpark 100\07-73,pubchem4795,acmc-209pjl,4-fluoro-2-nitrobenzonitrle,ksc497q7l,4-fluoro-2-nitro-benzonitrile,benzonitrile,4-fluoro-2-nitro,4-fluoro-2-nitrobenzenecarbonitrile PubChem CID: 2774652 IUPAC Name: 4-fluoro-2-nitrobenzonitrile SMILES: C1=CC(=C(C=C1F)[N+](=O)[O-])C#N

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Specifications

PubChem CID	2774652
CAS	80517-21-1
Molecular Weight (g/mol)	166.111
MDL Number	MFCD00277447
SMILES	C1=CC(=C(C=C1F)[N+](=O)[O-])C#N
Synonym	2-cyano-5-fluoronitrobenzene,benzonitrile, 4-fluoro-2-nitro,buttpark 100\07-73,pubchem4795,acmc-209pjl,4-fluoro-2-nitrobenzonitrle,ksc497q7l,4-fluoro-2-nitro-benzonitrile,benzonitrile,4-fluoro-2-nitro,4-fluoro-2-nitrobenzenecarbonitrile
IUPAC Name	4-fluoro-2-nitrobenzonitrile
InChI Key	MNEAKKQYFSYZEU-UHFFFAOYSA-N
Molecular Formula	C7H3FN2O2

4-Nitrophenyl formate, 98%

CAS: 1865-01-6 Molecular Formula: C7H5NO4 Molecular Weight (g/mol): 167.12 MDL Number: MFCD00014713 InChI Key: IEXRKQFZXJSHOB-UHFFFAOYSA-N PubChem CID: 74628 IUPAC Name: (4-nitrophenyl) formate SMILES: C1=CC(=CC=C1[N+](=O)[O-])OC=O

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Specifications

PubChem CID	74628
CAS	1865-01-6
Molecular Weight (g/mol)	167.12
MDL Number	MFCD00014713
SMILES	C1=CC(=CC=C1[N+](=O)[O-])OC=O
IUPAC Name	(4-nitrophenyl) formate
InChI Key	IEXRKQFZXJSHOB-UHFFFAOYSA-N
Molecular Formula	C7H5NO4

6-Nitro-1,3-dihydroisobenzofuran-1-one, 97%, Thermo Scientific™

CAS: 610-93-5 Molecular Formula: C8H5NO4 Molecular Weight (g/mol): 179.13 MDL Number: MFCD00033529 InChI Key: RNWGZXAHUPFXLL-UHFFFAOYSA-N Synonym: 6-nitrophthalide,6-nitroisobenzofuran-1 3h-one,6-nitro-3h-isobenzofuran-1-one,6-nitro-1,3-dihydroisobenzofuran-1-one,6-nitro-1 3h-isobenzofuranone,6-nitro-2-benzofuran-1 3h-one,1 3h-isobenzofuranone, 6-nitro,6-nitro-3-hydroisobenzofuran-1-one,6-nitro-1,3-dihydro-2-benzofuran-1-one,6-nitrophtalide PubChem CID: 223584 IUPAC Name: 6-nitro-1,3-dihydro-2-benzofuran-1-one SMILES: [O-][N+](=O)C1=CC=C2COC(=O)C2=C1

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Specifications

PubChem CID	223584
CAS	610-93-5
Molecular Weight (g/mol)	179.13
MDL Number	MFCD00033529
SMILES	[O-][N+](=O)C1=CC=C2COC(=O)C2=C1
Synonym	6-nitrophthalide,6-nitroisobenzofuran-1 3h-one,6-nitro-3h-isobenzofuran-1-one,6-nitro-1,3-dihydroisobenzofuran-1-one,6-nitro-1 3h-isobenzofuranone,6-nitro-2-benzofuran-1 3h-one,1 3h-isobenzofuranone, 6-nitro,6-nitro-3-hydroisobenzofuran-1-one,6-nitro-1,3-dihydro-2-benzofuran-1-one,6-nitrophtalide
IUPAC Name	6-nitro-1,3-dihydro-2-benzofuran-1-one
InChI Key	RNWGZXAHUPFXLL-UHFFFAOYSA-N
Molecular Formula	C8H5NO4

4-Fluoro-3-nitroaniline, 99%

CAS: 364-76-1 Molecular Formula: C6H5FN2O2 Molecular Weight (g/mol): 156.12 MDL Number: MFCD00007833 InChI Key: LLIOADBCFIXIEU-UHFFFAOYSA-N Synonym: 3-nitro-4-fluoroaniline,4-fluoro-3-nitrobenzenamine,benzenamine, 4-fluoro-3-nitro,aniline, 4-fluoro-3-nitro,4-fluoro-3-nitro-aniline,5-amino-2-fluoronitrobenzene,4-fluoro-3-nitro-phenylamine,3-nitro-4-fluoroanailine,3-nitro-4-fluoro aniline,4-fluoro-3-nitro aniline PubChem CID: 67768 ChEBI: CHEBI:48642 IUPAC Name: 4-fluoro-3-nitroaniline SMILES: NC1=CC=C(F)C(=C1)[N+]([O-])=O

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Specifications

PubChem CID	67768
CAS	364-76-1
Molecular Weight (g/mol)	156.12
ChEBI	CHEBI:48642
MDL Number	MFCD00007833
SMILES	NC1=CC=C(F)C(=C1)[N+]([O-])=O
Synonym	3-nitro-4-fluoroaniline,4-fluoro-3-nitrobenzenamine,benzenamine, 4-fluoro-3-nitro,aniline, 4-fluoro-3-nitro,4-fluoro-3-nitro-aniline,5-amino-2-fluoronitrobenzene,4-fluoro-3-nitro-phenylamine,3-nitro-4-fluoroanailine,3-nitro-4-fluoro aniline,4-fluoro-3-nitro aniline
IUPAC Name	4-fluoro-3-nitroaniline
InChI Key	LLIOADBCFIXIEU-UHFFFAOYSA-N
Molecular Formula	C6H5FN2O2

6-Nitroindole, 97%

CAS: 4769-96-4 Molecular Formula: C8H6N2O2 Molecular Weight (g/mol): 162.15 MDL Number: MFCD00051497 InChI Key: PSWCIARYGITEOY-UHFFFAOYSA-N Synonym: 6-nitroindole,1h-indole, 6-nitro,6-nitro-indole,6-nitro-ih-indole,pubchem7242,#,acmc-1aq0p PubChem CID: 78502 IUPAC Name: 6-nitro-1H-indole SMILES: [O-][N+](=O)C1=CC=C2C=CNC2=C1

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Specifications

PubChem CID	78502
CAS	4769-96-4
Molecular Weight (g/mol)	162.15
MDL Number	MFCD00051497
SMILES	[O-][N+](=O)C1=CC=C2C=CNC2=C1
Synonym	6-nitroindole,1h-indole, 6-nitro,6-nitro-indole,6-nitro-ih-indole,pubchem7242,#,acmc-1aq0p
IUPAC Name	6-nitro-1H-indole
InChI Key	PSWCIARYGITEOY-UHFFFAOYSA-N
Molecular Formula	C8H6N2O2

3-Nitrophthalic anhydride, 97%

CAS: 641-70-3 Molecular Formula: C8H3NO5 Molecular Weight (g/mol): 193.11 MDL Number: MFCD00005921 InChI Key: ROFZMKDROVBLNY-UHFFFAOYSA-N Synonym: 3-nitrophthalic anhydride,4-nitroisobenzofuran-1,3-dione,1,3-isobenzofurandione, 4-nitro,phthalic anhydride, 3-nitro,3-nitro phthalic anhydride,3-nitrophthalic acid anhydride,1,3-isobenzofurandione, nitro,4-nitro-isobenzofuran-1,3-dione,3-nitrophthalicanhydride,nitrophthalic anhydride PubChem CID: 21631 IUPAC Name: 4-nitro-2-benzofuran-1,3-dione SMILES: [O-][N+](=O)C1=CC=CC2=C1C(=O)OC2=O

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Specifications

PubChem CID	21631
CAS	641-70-3
Molecular Weight (g/mol)	193.11
MDL Number	MFCD00005921
SMILES	[O-][N+](=O)C1=CC=CC2=C1C(=O)OC2=O
Synonym	3-nitrophthalic anhydride,4-nitroisobenzofuran-1,3-dione,1,3-isobenzofurandione, 4-nitro,phthalic anhydride, 3-nitro,3-nitro phthalic anhydride,3-nitrophthalic acid anhydride,1,3-isobenzofurandione, nitro,4-nitro-isobenzofuran-1,3-dione,3-nitrophthalicanhydride,nitrophthalic anhydride
IUPAC Name	4-nitro-2-benzofuran-1,3-dione
InChI Key	ROFZMKDROVBLNY-UHFFFAOYSA-N
Molecular Formula	C8H3NO5

4-Chloro-2-fluoronitrobenzene, 98%, Thermo Scientific™

CAS: 700-37-8 Molecular Formula: C6H3ClFNO2 Molecular Weight (g/mol): 175.54 MDL Number: MFCD00042211 InChI Key: PTCPUGKKWNMITF-UHFFFAOYSA-N Synonym: 4-chloro-2-fluoronitrobenzene,2-fluoro-4-chloronitrobenzene,1-chloro-3-fluoro-4-nitrobenzene,benzene, 4-chloro-2-fluoro-1-nitro,4-chloro-2-fluoro-1-nitro-benzene,4-chlor-2-fluor-1-nitrobenzol,pubchem1051,acmc-1bl8e,4-chloro2-fluoronitrobenzene,ksc380m1b PubChem CID: 69691 IUPAC Name: 4-chloro-2-fluoro-1-nitrobenzene SMILES: [O-][N+](=O)C1=CC=C(Cl)C=C1F

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Specifications

PubChem CID	69691
CAS	700-37-8
Molecular Weight (g/mol)	175.54
MDL Number	MFCD00042211
SMILES	[O-][N+](=O)C1=CC=C(Cl)C=C1F
Synonym	4-chloro-2-fluoronitrobenzene,2-fluoro-4-chloronitrobenzene,1-chloro-3-fluoro-4-nitrobenzene,benzene, 4-chloro-2-fluoro-1-nitro,4-chloro-2-fluoro-1-nitro-benzene,4-chlor-2-fluor-1-nitrobenzol,pubchem1051,acmc-1bl8e,4-chloro2-fluoronitrobenzene,ksc380m1b
IUPAC Name	4-chloro-2-fluoro-1-nitrobenzene
InChI Key	PTCPUGKKWNMITF-UHFFFAOYSA-N
Molecular Formula	C6H3ClFNO2

1-Fluoro-2-nitrobenzene, 99%

CAS: 1493-27-2 Molecular Formula: C₆H₄FNO₂ Molecular Weight (g/mol): 141.1 MDL Number: MFCD00007048 InChI Key: PWKNBLFSJAVFAB-UHFFFAOYSA-N Synonym: 2-fluoronitrobenzene,o-fluoronitrobenzene,o-nitrofluorobenzene,2-nitrofluorobenzene,benzene, 1-fluoro-2-nitro,benzene, o-nitrofluoro,2-fluoro-1-nitrobenzene,fluoronitrobenzene,1-fluoro-2-nitro-benzene,benzene, fluoronitro PubChem CID: 73895 IUPAC Name: 1-fluoro-2-nitrobenzene SMILES: C1=CC=C(C(=C1)[N+](=O)[O-])F

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Specifications

PubChem CID	73895
CAS	1493-27-2
Molecular Weight (g/mol)	141.1
MDL Number	MFCD00007048
SMILES	C1=CC=C(C(=C1)[N+](=O)[O-])F
Synonym	2-fluoronitrobenzene,o-fluoronitrobenzene,o-nitrofluorobenzene,2-nitrofluorobenzene,benzene, 1-fluoro-2-nitro,benzene, o-nitrofluoro,2-fluoro-1-nitrobenzene,fluoronitrobenzene,1-fluoro-2-nitro-benzene,benzene, fluoronitro
IUPAC Name	1-fluoro-2-nitrobenzene
InChI Key	PWKNBLFSJAVFAB-UHFFFAOYSA-N
Molecular Formula	C₆H₄FNO₂

2-Nitrobenzonitrile, 98%, Thermo Scientific Chemicals

CAS: 612-24-8 Molecular Formula: C7H4N2O2 Molecular Weight (g/mol): 148.12 MDL Number: MFCD00007044 InChI Key: SWBDKCMOLSUXRH-UHFFFAOYSA-N Synonym: o-nitrobenzonitrile,o-cyanonitrobenzene,benzonitrile, o-nitro,benzonitrile, 2-nitro,2-cyanonitrobenzene,nitrobenzonitrile,unii-drc6u29fci,ccris 2326,1-nitro-2-cyanobenzene,2-nitrobenzenecarbonitrile PubChem CID: 11922 IUPAC Name: 2-nitrobenzonitrile SMILES: [O-][N+](=O)C1=CC=CC=C1C#N

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Specifications

PubChem CID	11922
CAS	612-24-8
Molecular Weight (g/mol)	148.12
MDL Number	MFCD00007044
SMILES	[O-][N+](=O)C1=CC=CC=C1C#N
Synonym	o-nitrobenzonitrile,o-cyanonitrobenzene,benzonitrile, o-nitro,benzonitrile, 2-nitro,2-cyanonitrobenzene,nitrobenzonitrile,unii-drc6u29fci,ccris 2326,1-nitro-2-cyanobenzene,2-nitrobenzenecarbonitrile
IUPAC Name	2-nitrobenzonitrile
InChI Key	SWBDKCMOLSUXRH-UHFFFAOYSA-N
Molecular Formula	C7H4N2O2

2-Chloro-5-nitrobenzonitrile, 99%

CAS: 16588-02-6 Molecular Formula: C7H3ClN2O2 Molecular Weight (g/mol): 182.563 MDL Number: MFCD00007292 InChI Key: ZGILLTVEEBNDOB-UHFFFAOYSA-N Synonym: benzonitrile, 2-chloro-5-nitro,2-chlor-5-nitrobenzonitril german,5-nitro-2-chlorobenzonitrile,chembl52706,2-chloro-5-nitro-benzonitrile,2-chloro-5-nitrobenzenecarbonitrile,4-chloro-3-cyano-1-nitrobenzene,2-chlor-5-nitrobenzonitril,pubchem4740,2-chloro-5-nitrobenzonitril PubChem CID: 85504 IUPAC Name: 2-chloro-5-nitrobenzonitrile SMILES: C1=CC(=C(C=C1[N+](=O)[O-])C#N)Cl

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Specifications

PubChem CID	85504
CAS	16588-02-6
Molecular Weight (g/mol)	182.563
MDL Number	MFCD00007292
SMILES	C1=CC(=C(C=C1[N+](=O)[O-])C#N)Cl
Synonym	benzonitrile, 2-chloro-5-nitro,2-chlor-5-nitrobenzonitril german,5-nitro-2-chlorobenzonitrile,chembl52706,2-chloro-5-nitro-benzonitrile,2-chloro-5-nitrobenzenecarbonitrile,4-chloro-3-cyano-1-nitrobenzene,2-chlor-5-nitrobenzonitril,pubchem4740,2-chloro-5-nitrobenzonitril
IUPAC Name	2-chloro-5-nitrobenzonitrile
InChI Key	ZGILLTVEEBNDOB-UHFFFAOYSA-N
Molecular Formula	C7H3ClN2O2

Organic oxoazanium compounds

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