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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 224 results
1

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

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
2

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

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
3

4-Nitrobenzonitrile, 97%

CAS: 619-72-7 Molecular Formula: C7H4N2O2 Molecular Weight (g/mol): 148.12 MDL Number: MFCD00007279 InChI Key: NKJIFDNZPGLLSH-UHFFFAOYSA-N Synonym: benzonitrile, 4-nitro,4-cyanonitrobenzene,p-nitrobenzonitrile,p-cyanonitrobenzene,benzonitrile, p-nitro,4-nitrobenzenecarbonitrile,1-nitro-4-cyanobenzene,4-nitro-benzonitrile,ccris 2328,4-nitrobenzonitril PubChem CID: 12090 IUPAC Name: 4-nitrobenzonitrile SMILES: [O-][N+](=O)C1=CC=C(C=C1)C#N

PubChem CID 12090
CAS 619-72-7
Molecular Weight (g/mol) 148.12
MDL Number MFCD00007279
SMILES [O-][N+](=O)C1=CC=C(C=C1)C#N
Synonym benzonitrile, 4-nitro,4-cyanonitrobenzene,p-nitrobenzonitrile,p-cyanonitrobenzene,benzonitrile, p-nitro,4-nitrobenzenecarbonitrile,1-nitro-4-cyanobenzene,4-nitro-benzonitrile,ccris 2328,4-nitrobenzonitril
IUPAC Name 4-nitrobenzonitrile
InChI Key NKJIFDNZPGLLSH-UHFFFAOYSA-N
Molecular Formula C7H4N2O2
4

1,4-Dinitrobenzene, 98%

CAS: 100-25-4 Molecular Formula: C6H4N2O4 Molecular Weight (g/mol): 168.11 MDL Number: MFCD00007314 InChI Key: FYFDQJRXFWGIBS-UHFFFAOYSA-N Synonym: p-dinitrobenzene,benzene, 1,4-dinitro,benzene, p-dinitro,dithane a-4,dinitrobenzene, p,dinitrobenzene, para,ccris 3092,1,4-dinitro-benzene,1,4-dinitrobenzene, analytical standard,para-dinitrobenzene PubChem CID: 7492 ChEBI: CHEBI:51398 IUPAC Name: 1,4-dinitrobenzene SMILES: C1=CC(=CC=C1[N+](=O)[O-])[N+](=O)[O-]

PubChem CID 7492
CAS 100-25-4
Molecular Weight (g/mol) 168.11
ChEBI CHEBI:51398
MDL Number MFCD00007314
SMILES C1=CC(=CC=C1[N+](=O)[O-])[N+](=O)[O-]
Synonym p-dinitrobenzene,benzene, 1,4-dinitro,benzene, p-dinitro,dithane a-4,dinitrobenzene, p,dinitrobenzene, para,ccris 3092,1,4-dinitro-benzene,1,4-dinitrobenzene, analytical standard,para-dinitrobenzene
IUPAC Name 1,4-dinitrobenzene
InChI Key FYFDQJRXFWGIBS-UHFFFAOYSA-N
Molecular Formula C6H4N2O4
5

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
6

3-Nitroaniline, 98%

CAS: 99-09-2 Molecular Formula: C6H6N2O2 Molecular Weight (g/mol): 138.13 MDL Number: MFCD00007782 InChI Key: XJCVRTZCHMZPBD-UHFFFAOYSA-N Synonym: m-nitroaniline,benzenamine, 3-nitro,3-nitrophenylamine,nitranilin,3-aminonitrobenzene,fast orange base r,azobase mna,devol orange r,m-nitrophenylamine,3-nitrobenzenamine PubChem CID: 7423 IUPAC Name: 3-nitroaniline SMILES: NC1=CC=CC(=C1)[N+]([O-])=O

PubChem CID 7423
CAS 99-09-2
Molecular Weight (g/mol) 138.13
MDL Number MFCD00007782
SMILES NC1=CC=CC(=C1)[N+]([O-])=O
Synonym m-nitroaniline,benzenamine, 3-nitro,3-nitrophenylamine,nitranilin,3-aminonitrobenzene,fast orange base r,azobase mna,devol orange r,m-nitrophenylamine,3-nitrobenzenamine
IUPAC Name 3-nitroaniline
InChI Key XJCVRTZCHMZPBD-UHFFFAOYSA-N
Molecular Formula C6H6N2O2
7

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

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
8

2-Chloro-4-fluoro-1-nitrobenzene, 98%

CAS: 2106-50-5 Molecular Formula: C6H3ClFNO2 Molecular Weight (g/mol): 175.543 MDL Number: MFCD03412200 InChI Key: KQOOFMWRLDRDAX-UHFFFAOYSA-N Synonym: 2-chloro-4-fluoronitrobenzene,1-chloro-5-fluoro-2-nitrobenzene,benzene, 2-chloro-4-fluoro-1-nitro,pubchem4342,acmc-209fh8,2-choro-4-fluoronitrobenzene,ksc205m1p,3-chloro-4-nitrofluorobenzene,4-fluoro-2-chloronitrobenzene,2-chloro-4-fluoronitrobenzenen PubChem CID: 75017 IUPAC Name: 2-chloro-4-fluoro-1-nitrobenzene SMILES: C1=CC(=C(C=C1F)Cl)[N+](=O)[O-]

PubChem CID 75017
CAS 2106-50-5
Molecular Weight (g/mol) 175.543
MDL Number MFCD03412200
SMILES C1=CC(=C(C=C1F)Cl)[N+](=O)[O-]
Synonym 2-chloro-4-fluoronitrobenzene,1-chloro-5-fluoro-2-nitrobenzene,benzene, 2-chloro-4-fluoro-1-nitro,pubchem4342,acmc-209fh8,2-choro-4-fluoronitrobenzene,ksc205m1p,3-chloro-4-nitrofluorobenzene,4-fluoro-2-chloronitrobenzene,2-chloro-4-fluoronitrobenzenen
IUPAC Name 2-chloro-4-fluoro-1-nitrobenzene
InChI Key KQOOFMWRLDRDAX-UHFFFAOYSA-N
Molecular Formula C6H3ClFNO2
9

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

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
10

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
11

2-Fluoro-5-nitrobenzonitrile, 98+%

CAS: 17417-09-3 Molecular Formula: C7H3FN2O2 Molecular Weight (g/mol): 166.11 MDL Number: MFCD00042299 InChI Key: YLACBMHBZVYOAP-UHFFFAOYSA-N Synonym: benzonitrile, 2-fluoro-5-nitro,3-cyano-4-fluoronitrobenzene,2-fluoro-5-nitro-benzonitrile,2-fluoro-5-nitrobenzenecarbonitrile,2-fluoro-5-nitrobenzenenitrile,3-cyano-4-fluoro-1-nitrobenzene,pubchem4792,intermediates-zcf02297,acmc-209e7w,5-nitro-2-fluorobenzonitrile PubChem CID: 519417 IUPAC Name: 2-fluoro-5-nitrobenzonitrile SMILES: [O-][N+](=O)C1=CC=C(F)C(=C1)C#N

PubChem CID 519417
CAS 17417-09-3
Molecular Weight (g/mol) 166.11
MDL Number MFCD00042299
SMILES [O-][N+](=O)C1=CC=C(F)C(=C1)C#N
Synonym benzonitrile, 2-fluoro-5-nitro,3-cyano-4-fluoronitrobenzene,2-fluoro-5-nitro-benzonitrile,2-fluoro-5-nitrobenzenecarbonitrile,2-fluoro-5-nitrobenzenenitrile,3-cyano-4-fluoro-1-nitrobenzene,pubchem4792,intermediates-zcf02297,acmc-209e7w,5-nitro-2-fluorobenzonitrile
IUPAC Name 2-fluoro-5-nitrobenzonitrile
InChI Key YLACBMHBZVYOAP-UHFFFAOYSA-N
Molecular Formula C7H3FN2O2
12

3,5-Dinitrobenzonitrile, 98%

CAS: 4110-35-4 Molecular Formula: C7H3N3O4 Molecular Weight (g/mol): 193.12 MDL Number: MFCD00007228 InChI Key: SSDNULNTQAUNFQ-UHFFFAOYSA-N Synonym: benzonitrile, 3,5-dinitro,3,5-dinitro-benzonitrile,3,5-dinitrobenzenecarbonitrile,acmc-209jih,3,5-bisnitrobenzonitrile,3,5-dinitrobenzonitrile,wln: wnr cnw ecn,benzonitrile,3,5-dinitro,1,3-dinitro-5-cyanobenzene,5-cyano-1,3-dinitrobenzene PubChem CID: 20062 IUPAC Name: 3,5-dinitrobenzonitrile SMILES: [O-][N+](=O)C1=CC(=CC(=C1)C#N)[N+]([O-])=O

PubChem CID 20062
CAS 4110-35-4
Molecular Weight (g/mol) 193.12
MDL Number MFCD00007228
SMILES [O-][N+](=O)C1=CC(=CC(=C1)C#N)[N+]([O-])=O
Synonym benzonitrile, 3,5-dinitro,3,5-dinitro-benzonitrile,3,5-dinitrobenzenecarbonitrile,acmc-209jih,3,5-bisnitrobenzonitrile,3,5-dinitrobenzonitrile,wln: wnr cnw ecn,benzonitrile,3,5-dinitro,1,3-dinitro-5-cyanobenzene,5-cyano-1,3-dinitrobenzene
IUPAC Name 3,5-dinitrobenzonitrile
InChI Key SSDNULNTQAUNFQ-UHFFFAOYSA-N
Molecular Formula C7H3N3O4
13

5-Nitrobenzothiazole, 96%, Thermo Scientific Chemicals

CAS: 2942-07-6 MDL Number: MFCD00085891

CAS 2942-07-6
MDL Number MFCD00085891
14

3,4-Dichloronitrobenzene, 95%, Thermo Scientific™

CAS: 99-54-7 Molecular Formula: C6H3Cl2NO2 Molecular Weight (g/mol): 192.00 MDL Number: MFCD00007207 InChI Key: NTBYINQTYWZXLH-UHFFFAOYSA-N Synonym: 3,4-dichloronitrobenzene,benzene, 1,2-dichloro-4-nitro,dcnb,1-nitro-3,4-dichlorobenzene,3,4-dichlornitrobenzen,unii-ijt74ji7fs,ccris 3097,1,2-dichloro-4-nitro-benzene,3,4-dichlornitrobenzen czech,3,4-dichloronitrobenzen czech PubChem CID: 7443 IUPAC Name: 1,2-dichloro-4-nitrobenzene SMILES: [O-][N+](=O)C1=CC=C(Cl)C(Cl)=C1

PubChem CID 7443
CAS 99-54-7
Molecular Weight (g/mol) 192.00
MDL Number MFCD00007207
SMILES [O-][N+](=O)C1=CC=C(Cl)C(Cl)=C1
Synonym 3,4-dichloronitrobenzene,benzene, 1,2-dichloro-4-nitro,dcnb,1-nitro-3,4-dichlorobenzene,3,4-dichlornitrobenzen,unii-ijt74ji7fs,ccris 3097,1,2-dichloro-4-nitro-benzene,3,4-dichlornitrobenzen czech,3,4-dichloronitrobenzen czech
IUPAC Name 1,2-dichloro-4-nitrobenzene
InChI Key NTBYINQTYWZXLH-UHFFFAOYSA-N
Molecular Formula C6H3Cl2NO2
15

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