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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.
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1 – 15 of 219 results
1

tert-Nitrobutane, 98+%

CAS: 594-70-7 Molecular Formula: C4H9NO2 Molecular Weight (g/mol): 103.121 MDL Number: MFCD00007393 InChI Key: AIMREYQYBFBEGQ-UHFFFAOYSA-N Synonym: propane, 2-methyl-2-nitro,trimethylnitromethane,2-nitroisobutane,2-nitro-2-methylpropane,tert-nitrobutane,1,1-dimethyl-1-nitroethane,nitro-tert-butane,2-methyl-2-nitro-propane,unii-9dkh5l679z,ccris 5044 PubChem CID: 11672 IUPAC Name: 2-methyl-2-nitropropane SMILES: CC(C)(C)[N+](=O)[O-]

PubChem CID 11672
CAS 594-70-7
Molecular Weight (g/mol) 103.121
MDL Number MFCD00007393
SMILES CC(C)(C)[N+](=O)[O-]
Synonym propane, 2-methyl-2-nitro,trimethylnitromethane,2-nitroisobutane,2-nitro-2-methylpropane,tert-nitrobutane,1,1-dimethyl-1-nitroethane,nitro-tert-butane,2-methyl-2-nitro-propane,unii-9dkh5l679z,ccris 5044
IUPAC Name 2-methyl-2-nitropropane
InChI Key AIMREYQYBFBEGQ-UHFFFAOYSA-N
Molecular Formula C4H9NO2
2

1-Chloro-2-nitrobenzene, 99+%

CAS: 88-73-3 Molecular Formula: C6H4ClNO2 Molecular Weight (g/mol): 157.55 MDL Number: MFCD00007061 InChI Key: BFCFYVKQTRLZHA-UHFFFAOYSA-N Synonym: 2-chloronitrobenzene,o-chloronitrobenzene,2-nitrochlorobenzene,chloronitrobenzene,o-nitrochlorobenzene,benzene, 1-chloro-2-nitro,2-chloro-1-nitrobenzene,oncb,benzene, chloronitro,nitrochlorobenzene PubChem CID: 6945 ChEBI: CHEBI:34270 IUPAC Name: 1-chloro-2-nitrobenzene SMILES: [O-][N+](=O)C1=CC=CC=C1Cl

PubChem CID 6945
CAS 88-73-3
Molecular Weight (g/mol) 157.55
ChEBI CHEBI:34270
MDL Number MFCD00007061
SMILES [O-][N+](=O)C1=CC=CC=C1Cl
Synonym 2-chloronitrobenzene,o-chloronitrobenzene,2-nitrochlorobenzene,chloronitrobenzene,o-nitrochlorobenzene,benzene, 1-chloro-2-nitro,2-chloro-1-nitrobenzene,oncb,benzene, chloronitro,nitrochlorobenzene
IUPAC Name 1-chloro-2-nitrobenzene
InChI Key BFCFYVKQTRLZHA-UHFFFAOYSA-N
Molecular Formula C6H4ClNO2
3

4-Fluoro-3-nitroaniline, 98%

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

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
4

Nitromethane, 96%, ACS reagent

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

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
5

7-Methyl-8-nitroquinoline, 98+%

CAS: 7471-63-8 Molecular Formula: C10H8N2O2 Molecular Weight (g/mol): 188.186 MDL Number: MFCD00041234 InChI Key: ZZDTVYJYMRSNQL-UHFFFAOYSA-N Synonym: quinoline, 7-methyl-8-nitro,8-nitro-7-methylquinoline,7-methyl-8-nitro-quinoline,acmc-1bcox,7-methyl 8-nitroquinoline PubChem CID: 81981 IUPAC Name: 7-methyl-8-nitroquinoline SMILES: CC1=C(C2=C(C=CC=N2)C=C1)[N+](=O)[O-]

PubChem CID 81981
CAS 7471-63-8
Molecular Weight (g/mol) 188.186
MDL Number MFCD00041234
SMILES CC1=C(C2=C(C=CC=N2)C=C1)[N+](=O)[O-]
Synonym quinoline, 7-methyl-8-nitro,8-nitro-7-methylquinoline,7-methyl-8-nitro-quinoline,acmc-1bcox,7-methyl 8-nitroquinoline
IUPAC Name 7-methyl-8-nitroquinoline
InChI Key ZZDTVYJYMRSNQL-UHFFFAOYSA-N
Molecular Formula C10H8N2O2
6

2-Chloro-1,3-dinitrobenzene, 98+%

CAS: 606-21-3 Molecular Formula: C6H3ClN2O4 Molecular Weight (g/mol): 202.55 MDL Number: MFCD00014689 InChI Key: BPPMIQPXQVIZNJ-UHFFFAOYSA-N Synonym: 2,6-dinitrochlorobenzene,1-chloro-2,6-dinitrobenzene,benzene, 2-chloro-1,3-dinitro,2-chloro-1,3-dintrobenzene,1,3-dinitro-2-chlorobenzene,2-chloro-1,3-dinitro-benzene,unii-lg72rnd0ab,lg72rnd0ab,1-chloro-2,3-dinitrobenzene mixture,ambsclk-136 PubChem CID: 11814 IUPAC Name: 2-chloro-1,3-dinitrobenzene SMILES: [O-][N+](=O)C1=CC=CC(=C1Cl)[N+]([O-])=O

PubChem CID 11814
CAS 606-21-3
Molecular Weight (g/mol) 202.55
MDL Number MFCD00014689
SMILES [O-][N+](=O)C1=CC=CC(=C1Cl)[N+]([O-])=O
Synonym 2,6-dinitrochlorobenzene,1-chloro-2,6-dinitrobenzene,benzene, 2-chloro-1,3-dinitro,2-chloro-1,3-dintrobenzene,1,3-dinitro-2-chlorobenzene,2-chloro-1,3-dinitro-benzene,unii-lg72rnd0ab,lg72rnd0ab,1-chloro-2,3-dinitrobenzene mixture,ambsclk-136
IUPAC Name 2-chloro-1,3-dinitrobenzene
InChI Key BPPMIQPXQVIZNJ-UHFFFAOYSA-N
Molecular Formula C6H3ClN2O4
7

4-Nitrodiphenylamine, 98+%

CAS: 836-30-6 Molecular Formula: C12H10N2O2 Molecular Weight (g/mol): 214.22 MDL Number: MFCD00007301 InChI Key: XXYMSQQCBUKFHE-UHFFFAOYSA-N Synonym: 4-nitrodiphenylamine,p-nitrodiphenylamine,benzenamine, 4-nitro-n-phenyl,diphenylamine, 4-nitro,4-nitrodifenylamin,4-ndpa,p-nitrophenylphenylamine,4-nitro-n-phenyl-aniline,4-nitrophenyl phenylamine,4-nitrodifenylamin czech PubChem CID: 13271 IUPAC Name: 4-nitro-N-phenylaniline SMILES: [O-][N+](=O)C1=CC=C(NC2=CC=CC=C2)C=C1

PubChem CID 13271
CAS 836-30-6
Molecular Weight (g/mol) 214.22
MDL Number MFCD00007301
SMILES [O-][N+](=O)C1=CC=C(NC2=CC=CC=C2)C=C1
Synonym 4-nitrodiphenylamine,p-nitrodiphenylamine,benzenamine, 4-nitro-n-phenyl,diphenylamine, 4-nitro,4-nitrodifenylamin,4-ndpa,p-nitrophenylphenylamine,4-nitro-n-phenyl-aniline,4-nitrophenyl phenylamine,4-nitrodifenylamin czech
IUPAC Name 4-nitro-N-phenylaniline
InChI Key XXYMSQQCBUKFHE-UHFFFAOYSA-N
Molecular Formula C12H10N2O2
8

Nitrobenzene, 99%

CAS: 98-95-3 Molecular Formula: C6H5NO2 Molecular Weight (g/mol): 123.111 MDL Number: MFCD00007043 InChI Key: LQNUZADURLCDLV-UHFFFAOYSA-N Synonym: nitrobenzol,benzene, nitro,oil of mirbane,mirbane oil,essence of mirbane,nitro-benzene,nitrobenzeen,oil of myrbane,nitrobenzen,mononitrobenzene PubChem CID: 7416 ChEBI: CHEBI:27798 IUPAC Name: nitrobenzene SMILES: C1=CC=C(C=C1)[N+](=O)[O-]

PubChem CID 7416
CAS 98-95-3
Molecular Weight (g/mol) 123.111
ChEBI CHEBI:27798
MDL Number MFCD00007043
SMILES C1=CC=C(C=C1)[N+](=O)[O-]
Synonym nitrobenzol,benzene, nitro,oil of mirbane,mirbane oil,essence of mirbane,nitro-benzene,nitrobenzeen,oil of myrbane,nitrobenzen,mononitrobenzene
IUPAC Name nitrobenzene
InChI Key LQNUZADURLCDLV-UHFFFAOYSA-N
Molecular Formula C6H5NO2
9

Ethyl 7-nitroindole-2-carboxylate, 95%

CAS: 6960-46-9 Molecular Formula: C11H10N2O4 Molecular Weight (g/mol): 234.211 MDL Number: MFCD00216475 InChI Key: GTZAIVBXGPLYGD-UHFFFAOYSA-N Synonym: ethyl 7-nitroindole-2-carboxylate,7-nitroindole-2-carboxylic acid ethyl ester,1h-indole-2-carboxylic acid, 7-nitro-, ethyl ester,ethyl-7-nitro-1h-indole-2-carboxylate,2-carbethoxy-7-nitroindole,ethyl 7-nitro-2-indolecarboxylate,indole-2-carboxylic acid, 7-nitro-, ethyl ester,1h-indole-2-carboxylicacid, 7-nitro-, ethyl ester PubChem CID: 250407 IUPAC Name: ethyl 7-nitro-1H-indole-2-carboxylate SMILES: CCOC(=O)C1=CC2=C(N1)C(=CC=C2)[N+](=O)[O-]

PubChem CID 250407
CAS 6960-46-9
Molecular Weight (g/mol) 234.211
MDL Number MFCD00216475
SMILES CCOC(=O)C1=CC2=C(N1)C(=CC=C2)[N+](=O)[O-]
Synonym ethyl 7-nitroindole-2-carboxylate,7-nitroindole-2-carboxylic acid ethyl ester,1h-indole-2-carboxylic acid, 7-nitro-, ethyl ester,ethyl-7-nitro-1h-indole-2-carboxylate,2-carbethoxy-7-nitroindole,ethyl 7-nitro-2-indolecarboxylate,indole-2-carboxylic acid, 7-nitro-, ethyl ester,1h-indole-2-carboxylicacid, 7-nitro-, ethyl ester
IUPAC Name ethyl 7-nitro-1H-indole-2-carboxylate
InChI Key GTZAIVBXGPLYGD-UHFFFAOYSA-N
Molecular Formula C11H10N2O4
10

1-Chloro-4-nitrobenzene, 99%

CAS: 100-00-5 Molecular Formula: C6H4ClNO2 Molecular Weight (g/mol): 157.56 MDL Number: MFCD00007285 InChI Key: CZGCEKJOLUNIFY-UHFFFAOYSA-N Synonym: 4-chloronitrobenzene,p-chloronitrobenzene,p-nitrochlorobenzene,benzene, 1-chloro-4-nitro,4-nitrochlorobenzene,pncb,4-chloro-1-nitrobenzene,p-nitrophenyl chloride,p-nitrochlorobenzol,p-nitroclorobenzene PubChem CID: 7474 ChEBI: CHEBI:34399 IUPAC Name: 1-chloro-4-nitrobenzene SMILES: C1=CC(=CC=C1[N+](=O)[O-])Cl

PubChem CID 7474
CAS 100-00-5
Molecular Weight (g/mol) 157.56
ChEBI CHEBI:34399
MDL Number MFCD00007285
SMILES C1=CC(=CC=C1[N+](=O)[O-])Cl
Synonym 4-chloronitrobenzene,p-chloronitrobenzene,p-nitrochlorobenzene,benzene, 1-chloro-4-nitro,4-nitrochlorobenzene,pncb,4-chloro-1-nitrobenzene,p-nitrophenyl chloride,p-nitrochlorobenzol,p-nitroclorobenzene
IUPAC Name 1-chloro-4-nitrobenzene
InChI Key CZGCEKJOLUNIFY-UHFFFAOYSA-N
Molecular Formula C6H4ClNO2
11

1-Chloro-2-nitrobenzene, 99%

CAS: 88-73-3 Molecular Formula: C6H4ClNO2 Molecular Weight (g/mol): 157.55 MDL Number: MFCD00007061 InChI Key: BFCFYVKQTRLZHA-UHFFFAOYSA-N Synonym: 2-chloronitrobenzene,o-chloronitrobenzene,2-nitrochlorobenzene,chloronitrobenzene,o-nitrochlorobenzene,benzene, 1-chloro-2-nitro,2-chloro-1-nitrobenzene,oncb,benzene, chloronitro,nitrochlorobenzene PubChem CID: 6945 ChEBI: CHEBI:34270 IUPAC Name: 1-chloro-2-nitrobenzene SMILES: [O-][N+](=O)C1=CC=CC=C1Cl

PubChem CID 6945
CAS 88-73-3
Molecular Weight (g/mol) 157.55
ChEBI CHEBI:34270
MDL Number MFCD00007061
SMILES [O-][N+](=O)C1=CC=CC=C1Cl
Synonym 2-chloronitrobenzene,o-chloronitrobenzene,2-nitrochlorobenzene,chloronitrobenzene,o-nitrochlorobenzene,benzene, 1-chloro-2-nitro,2-chloro-1-nitrobenzene,oncb,benzene, chloronitro,nitrochlorobenzene
IUPAC Name 1-chloro-2-nitrobenzene
InChI Key BFCFYVKQTRLZHA-UHFFFAOYSA-N
Molecular Formula C6H4ClNO2
12

1-Chloro-4-nitrobenzene, 98+%

CAS: 100-00-5 Molecular Formula: C6H4ClNO2 Molecular Weight (g/mol): 157.553 MDL Number: MFCD00007285 InChI Key: CZGCEKJOLUNIFY-UHFFFAOYSA-N Synonym: 4-chloronitrobenzene,p-chloronitrobenzene,p-nitrochlorobenzene,benzene, 1-chloro-4-nitro,4-nitrochlorobenzene,pncb,4-chloro-1-nitrobenzene,p-nitrophenyl chloride,p-nitrochlorobenzol,p-nitroclorobenzene PubChem CID: 7474 ChEBI: CHEBI:34399 IUPAC Name: 1-chloro-4-nitrobenzene SMILES: C1=CC(=CC=C1[N+](=O)[O-])Cl

PubChem CID 7474
CAS 100-00-5
Molecular Weight (g/mol) 157.553
ChEBI CHEBI:34399
MDL Number MFCD00007285
SMILES C1=CC(=CC=C1[N+](=O)[O-])Cl
Synonym 4-chloronitrobenzene,p-chloronitrobenzene,p-nitrochlorobenzene,benzene, 1-chloro-4-nitro,4-nitrochlorobenzene,pncb,4-chloro-1-nitrobenzene,p-nitrophenyl chloride,p-nitrochlorobenzol,p-nitroclorobenzene
IUPAC Name 1-chloro-4-nitrobenzene
InChI Key CZGCEKJOLUNIFY-UHFFFAOYSA-N
Molecular Formula C6H4ClNO2
13

1-Fluoro-2-nitrobenzene, 99%

CAS: 1493-27-2 Molecular Formula: C6H4FNO2 Molecular Weight (g/mol): 141.101 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

PubChem CID 73895
CAS 1493-27-2
Molecular Weight (g/mol) 141.101
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
14

6-Cyano-7-nitro-1,4-dihydroquinoxaline-2,3-dione, 98%

CAS: 115066-14-3 Molecular Formula: C9H4N4O4 Molecular Weight (g/mol): 232.155 MDL Number: MFCD00069232 InChI Key: RPXVIAFEQBNEAX-UHFFFAOYSA-N Synonym: cnqx,6-cyano-7-nitroquinoxaline-2,3-dione,unii-6ote87sccw,7-nitro-2,3-dioxo-1,2,3,4-tetrahydroquinoxaline-6-carbonitrile,6ote87sccw,3h cnqx,6-cyano-2,3-dihydroxy-7-nitroquinoxaline,1,4-dihydro-2,3-dihydroxy-7-nitro-6-quinoxalinecarbonitrile,6-quinoxalinecarbonitrile, 1,2,3,4-tetrahydro-7-nitro-2,3-dioxo,2,3-dihydroxy-7-nitro-6-quinoxalinecarbonitrile PubChem CID: 3721046 ChEBI: CHEBI:34468 IUPAC Name: 7-nitro-2,3-dioxo-1,4-dihydroquinoxaline-6-carbonitrile SMILES: C1=C(C(=CC2=C1NC(=O)C(=O)N2)[N+](=O)[O-])C#N

PubChem CID 3721046
CAS 115066-14-3
Molecular Weight (g/mol) 232.155
ChEBI CHEBI:34468
MDL Number MFCD00069232
SMILES C1=C(C(=CC2=C1NC(=O)C(=O)N2)[N+](=O)[O-])C#N
Synonym cnqx,6-cyano-7-nitroquinoxaline-2,3-dione,unii-6ote87sccw,7-nitro-2,3-dioxo-1,2,3,4-tetrahydroquinoxaline-6-carbonitrile,6ote87sccw,3h cnqx,6-cyano-2,3-dihydroxy-7-nitroquinoxaline,1,4-dihydro-2,3-dihydroxy-7-nitro-6-quinoxalinecarbonitrile,6-quinoxalinecarbonitrile, 1,2,3,4-tetrahydro-7-nitro-2,3-dioxo,2,3-dihydroxy-7-nitro-6-quinoxalinecarbonitrile
IUPAC Name 7-nitro-2,3-dioxo-1,4-dihydroquinoxaline-6-carbonitrile
InChI Key RPXVIAFEQBNEAX-UHFFFAOYSA-N
Molecular Formula C9H4N4O4
15

4-Chloro-3-nitrobenzonitrile, 98%

CAS: 939-80-0 Molecular Formula: C7H3ClN2O2 Molecular Weight (g/mol): 182.563 MDL Number: MFCD00016987 InChI Key: XBLPHYSLHRGMNW-UHFFFAOYSA-N Synonym: 3-nitro-4-chlorobenzonitrile,4-chloro-3-nitro-benzonitrile,benzonitrile, 4-chloro-3-nitro,4-chlor-3-nitrobenzonitril,2-chloro-5-cyanonitrobenzene,4-chlor-3-nitrobenzonitril czech,4-chloro-3-nitro-benzonitril,chembl54162,4-09-00-01227 beilstein handbook reference,4-chloro-3-nitrobenzenecarbonitrile PubChem CID: 13655 IUPAC Name: 4-chloro-3-nitrobenzonitrile SMILES: C1=CC(=C(C=C1C#N)[N+](=O)[O-])Cl

PubChem CID 13655
CAS 939-80-0
Molecular Weight (g/mol) 182.563
MDL Number MFCD00016987
SMILES C1=CC(=C(C=C1C#N)[N+](=O)[O-])Cl
Synonym 3-nitro-4-chlorobenzonitrile,4-chloro-3-nitro-benzonitrile,benzonitrile, 4-chloro-3-nitro,4-chlor-3-nitrobenzonitril,2-chloro-5-cyanonitrobenzene,4-chlor-3-nitrobenzonitril czech,4-chloro-3-nitro-benzonitril,chembl54162,4-09-00-01227 beilstein handbook reference,4-chloro-3-nitrobenzenecarbonitrile
IUPAC Name 4-chloro-3-nitrobenzonitrile
InChI Key XBLPHYSLHRGMNW-UHFFFAOYSA-N
Molecular Formula C7H3ClN2O2