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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181 – 195 of 652 results

181

3-Chloro-4-fluoronitrobenzene 95.0+%, TCI America™

CAS: 350-30-1 Molecular Formula: C6H3ClFNO2 Molecular Weight (g/mol): 175.54 MDL Number: MFCD00007206 InChI Key: DPHCXXYPSYMICK-UHFFFAOYSA-N Synonym: 3-chloro-4-fluoronitrobenzene,benzene, 2-chloro-1-fluoro-4-nitro,3-chloro-4-fluoro-1-nitrobenzene,4-fluoro-3-chloronitrobenzene,1-chloro-2-fluoro-5-nitrobenzene,2-chloro-1-fluoro-4-nitro-benzene,3-chloro-4-fluoro-nitrobenzene,pubchem8539,acmc-209icj,dsstox_cid_29134 PubChem CID: 67688 IUPAC Name: 2-chloro-1-fluoro-4-nitrobenzene SMILES: [O-][N+](=O)C1=CC=C(F)C(Cl)=C1

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PubChem CID	67688
CAS	350-30-1
Molecular Weight (g/mol)	175.54
MDL Number	MFCD00007206
SMILES	[O-][N+](=O)C1=CC=C(F)C(Cl)=C1
Synonym	3-chloro-4-fluoronitrobenzene,benzene, 2-chloro-1-fluoro-4-nitro,3-chloro-4-fluoro-1-nitrobenzene,4-fluoro-3-chloronitrobenzene,1-chloro-2-fluoro-5-nitrobenzene,2-chloro-1-fluoro-4-nitro-benzene,3-chloro-4-fluoro-nitrobenzene,pubchem8539,acmc-209icj,dsstox_cid_29134
IUPAC Name	2-chloro-1-fluoro-4-nitrobenzene
InChI Key	DPHCXXYPSYMICK-UHFFFAOYSA-N
Molecular Formula	C6H3ClFNO2

182

3-Nitrophenylsulfur Pentafluoride 96.0+%, TCI America™

CAS: 2613-26-5 Molecular Formula: C6H4F5NO2S Molecular Weight (g/mol): 249.155 MDL Number: MFCD00221621 InChI Key: FSTNQYCPXJMFMT-UHFFFAOYSA-N Synonym: 3-nitrophenylsulfur pentafluoride,3-nitrophenylsulphur pentafluoride,1-nitro-3-pentafluorosulfanyl benzene,1-nitro-3-pentafluoro-??-sulfanyl benzene,acmc-209goj,pentafluoro-3-nitrophenyl,3-pentafluorothio nitrobenzene,3-nitropentafluorosulfanylbenzene,3-pentafluorosulphanylnitrobenzene,3-pentafluorosulfur-nitrobenzene PubChem CID: 2775738 IUPAC Name: pentafluoro-(3-nitrophenyl)-$l^{6}-sulfane SMILES: C1=CC(=CC(=C1)S(F)(F)(F)(F)F)[N+](=O)[O-]

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PubChem CID	2775738
CAS	2613-26-5
Molecular Weight (g/mol)	249.155
MDL Number	MFCD00221621
SMILES	C1=CC(=CC(=C1)S(F)(F)(F)(F)F)[N+](=O)[O-]
Synonym	3-nitrophenylsulfur pentafluoride,3-nitrophenylsulphur pentafluoride,1-nitro-3-pentafluorosulfanyl benzene,1-nitro-3-pentafluoro-??-sulfanyl benzene,acmc-209goj,pentafluoro-3-nitrophenyl,3-pentafluorothio nitrobenzene,3-nitropentafluorosulfanylbenzene,3-pentafluorosulphanylnitrobenzene,3-pentafluorosulfur-nitrobenzene
IUPAC Name	pentafluoro-(3-nitrophenyl)-$l^{6}-sulfane
InChI Key	FSTNQYCPXJMFMT-UHFFFAOYSA-N
Molecular Formula	C6H4F5NO2S

183

4-Nitrobenzonitrile 98.0+%, TCI America™

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

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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

184

3-Nitrobenzonitrile 99.0+%, TCI America™

CAS: 619-24-9 Molecular Formula: C7H4N2O2 Molecular Weight (g/mol): 148.121 MDL Number: MFCD00007194 InChI Key: RUSAWEHOGCWOPG-UHFFFAOYSA-N Synonym: benzonitrile, 3-nitro,m-nitrobenzonitrile,3-cyanonitrobenzene,m-cyanonitrobenzene,benzonitrile, m-nitro,3-cyano-1-nitrobenzene,3-nitro-benzonitrile,ccris 2327,3-nitrobenzenecarbonitrile,3-nitrobenzonitril PubChem CID: 12079 IUPAC Name: 3-nitrobenzonitrile SMILES: C1=CC(=CC(=C1)[N+](=O)[O-])C#N

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PubChem CID	12079
CAS	619-24-9
Molecular Weight (g/mol)	148.121
MDL Number	MFCD00007194
SMILES	C1=CC(=CC(=C1)[N+](=O)[O-])C#N
Synonym	benzonitrile, 3-nitro,m-nitrobenzonitrile,3-cyanonitrobenzene,m-cyanonitrobenzene,benzonitrile, m-nitro,3-cyano-1-nitrobenzene,3-nitro-benzonitrile,ccris 2327,3-nitrobenzenecarbonitrile,3-nitrobenzonitril
IUPAC Name	3-nitrobenzonitrile
InChI Key	RUSAWEHOGCWOPG-UHFFFAOYSA-N
Molecular Formula	C7H4N2O2

185

6-Nitroindole 98.0+%, TCI America™

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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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

186

2,3,5,6-Tetrachloronitrobenzene 98.0+%, TCI America™

CAS: 117-18-0 Molecular Formula: C6HCl4NO2 Molecular Weight (g/mol): 260.879 MDL Number: MFCD00007066 InChI Key: XQTLDIFVVHJORV-UHFFFAOYSA-N Synonym: tecnazene,tecnazen,2,3,5,6-tetrachloronitrobenzene,arena,folosan,fusarex,myfusan,hickstor,turbostore,easytec PubChem CID: 8330 ChEBI: CHEBI:82044 IUPAC Name: 1,2,4,5-tetrachloro-3-nitrobenzene SMILES: C1=C(C(=C(C(=C1Cl)Cl)[N+](=O)[O-])Cl)Cl

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Specifications

PubChem CID	8330
CAS	117-18-0
Molecular Weight (g/mol)	260.879
ChEBI	CHEBI:82044
MDL Number	MFCD00007066
SMILES	C1=C(C(=C(C(=C1Cl)Cl)[N+](=O)[O-])Cl)Cl
Synonym	tecnazene,tecnazen,2,3,5,6-tetrachloronitrobenzene,arena,folosan,fusarex,myfusan,hickstor,turbostore,easytec
IUPAC Name	1,2,4,5-tetrachloro-3-nitrobenzene
InChI Key	XQTLDIFVVHJORV-UHFFFAOYSA-N
Molecular Formula	C6HCl4NO2

187

2,3,4-Trichloronitrobenzene 99.0+%, TCI America™

CAS: 17700-09-3 Molecular Formula: C6H2Cl3NO2 Molecular Weight (g/mol): 226.437 MDL Number: MFCD00007063 InChI Key: BGKIECJVXXHLDP-UHFFFAOYSA-N Synonym: 2,3,4-trichloronitrobenzene,trichloronitrobenzene,2,3,4-trichloro-1-nitrobenzene,4-nitro-1,2,3-trichlorobenzene,benzene, 1,2,3-trichloro-4-nitro,benzene, 4-nitro-1,2,3-trichloro,1,2,3-trichloronitrobenzene,1,2,3-tris chloranyl-4-nitro-benzene,pubchem8437,acmc-1bpdn PubChem CID: 28697 IUPAC Name: 1,2,3-trichloro-4-nitrobenzene SMILES: C1=CC(=C(C(=C1[N+](=O)[O-])Cl)Cl)Cl

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PubChem CID	28697
CAS	17700-09-3
Molecular Weight (g/mol)	226.437
MDL Number	MFCD00007063
SMILES	C1=CC(=C(C(=C1[N+](=O)[O-])Cl)Cl)Cl
Synonym	2,3,4-trichloronitrobenzene,trichloronitrobenzene,2,3,4-trichloro-1-nitrobenzene,4-nitro-1,2,3-trichlorobenzene,benzene, 1,2,3-trichloro-4-nitro,benzene, 4-nitro-1,2,3-trichloro,1,2,3-trichloronitrobenzene,1,2,3-tris chloranyl-4-nitro-benzene,pubchem8437,acmc-1bpdn
IUPAC Name	1,2,3-trichloro-4-nitrobenzene
InChI Key	BGKIECJVXXHLDP-UHFFFAOYSA-N
Molecular Formula	C6H2Cl3NO2

188

3-Nitrophenylacetic Acid 98.0+%, TCI America™

CAS: 1877-73-2 Molecular Formula: C8H7NO4 Molecular Weight (g/mol): 181.147 MDL Number: MFCD00007278 InChI Key: WUKHOVCMWXMOOA-UHFFFAOYSA-N Synonym: 3-nitrophenylacetic acid,2-3-nitrophenyl acetic acid,3-nitrophenyl acetic acid,benzeneacetic acid, 3-nitro,m-nitrophenyl acetic acid,m-nitrophenylacetic acid,3-nitrobenzeneacetic acid,acetic acid, m-nitrophenyl,ccris 2337 PubChem CID: 15876 SMILES: C1=CC(=CC(=C1)[N+](=O)[O-])CC(=O)O

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PubChem CID	15876
CAS	1877-73-2
Molecular Weight (g/mol)	181.147
MDL Number	MFCD00007278
SMILES	C1=CC(=CC(=C1)[N+](=O)[O-])CC(=O)O
Synonym	3-nitrophenylacetic acid,2-3-nitrophenyl acetic acid,3-nitrophenyl acetic acid,benzeneacetic acid, 3-nitro,m-nitrophenyl acetic acid,m-nitrophenylacetic acid,3-nitrobenzeneacetic acid,acetic acid, m-nitrophenyl,ccris 2337
InChI Key	WUKHOVCMWXMOOA-UHFFFAOYSA-N
Molecular Formula	C8H7NO4

189

Ethyl 4-Nitropyrrole-2-carboxylate 98.0+%, TCI America™

CAS: 5930-92-7 Molecular Formula: C7H8N2O4 Molecular Weight (g/mol): 184.151 MDL Number: MFCD00059927 InChI Key: PEORWHVRWXGKMS-UHFFFAOYSA-N Synonym: 4-Nitropyrrole-2-carboxylic Acid Ethyl Ester PubChem CID: 242169 IUPAC Name: ethyl 4-nitro-1H-pyrrole-2-carboxylate SMILES: CCOC(=O)C1=CC(=CN1)[N+](=O)[O-]

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PubChem CID	242169
CAS	5930-92-7
Molecular Weight (g/mol)	184.151
MDL Number	MFCD00059927
SMILES	CCOC(=O)C1=CC(=CN1)[N+](=O)[O-]
Synonym	4-Nitropyrrole-2-carboxylic Acid Ethyl Ester
IUPAC Name	ethyl 4-nitro-1H-pyrrole-2-carboxylate
InChI Key	PEORWHVRWXGKMS-UHFFFAOYSA-N
Molecular Formula	C7H8N2O4

190

3-Nitrodiphenyl 99.0+%, TCI America™

CAS: 2113-58-8 Molecular Formula: C12H9NO2 Molecular Weight (g/mol): 199.209 MDL Number: MFCD00007245 InChI Key: FYRPEHRWMVMHQM-UHFFFAOYSA-N Synonym: 3-nitrobiphenyl,biphenyl, 3-nitro,m-nitrobiphenyl,3-nitro-1,1'-biphenyl,1,1'-biphenyl, 3-nitro,3-nitrodiphenyl,1,1'-biphenyl, 3-nitro-9ci,m-nitrodiphenyl,3'-nitrobiphenyl,acmc-209fhv PubChem CID: 16450 IUPAC Name: 1-nitro-3-phenylbenzene SMILES: C1=CC=C(C=C1)C2=CC(=CC=C2)[N+](=O)[O-]

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PubChem CID	16450
CAS	2113-58-8
Molecular Weight (g/mol)	199.209
MDL Number	MFCD00007245
SMILES	C1=CC=C(C=C1)C2=CC(=CC=C2)[N+](=O)[O-]
Synonym	3-nitrobiphenyl,biphenyl, 3-nitro,m-nitrobiphenyl,3-nitro-1,1'-biphenyl,1,1'-biphenyl, 3-nitro,3-nitrodiphenyl,1,1'-biphenyl, 3-nitro-9ci,m-nitrodiphenyl,3'-nitrobiphenyl,acmc-209fhv
IUPAC Name	1-nitro-3-phenylbenzene
InChI Key	FYRPEHRWMVMHQM-UHFFFAOYSA-N
Molecular Formula	C12H9NO2

191

4-Nitrophenylsulfur Pentafluoride 96.0+%, TCI America™

CAS: 2613-27-6 Molecular Formula: C6H4F5NO2S Molecular Weight (g/mol): 249.155 MDL Number: MFCD00221619 InChI Key: AGNCKMHGYZKMLN-UHFFFAOYSA-N Synonym: 4-nitrophenylsulfur pentafluoride,4-nitrophenylsulphur pentafluoride,4-pentafluorosulfur-nitrobenzene,1-nitro-4-pentafluorosulfanyl benzene,1-nitro-4-pentafluoro-??-sulfanyl benzene,acmc-209gok,pentafluoro-4-nitrophenyl,4-pentafluorothio nitrobenzene,4-nitrophenylsulfurpentafluoride,4-nitrophenylpentafluorosulfur vi PubChem CID: 2775740 IUPAC Name: pentafluoro-(4-nitrophenyl)-$l^{6}-sulfane SMILES: C1=CC(=CC=C1[N+](=O)[O-])S(F)(F)(F)(F)F

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Specifications

PubChem CID	2775740
CAS	2613-27-6
Molecular Weight (g/mol)	249.155
MDL Number	MFCD00221619
SMILES	C1=CC(=CC=C1[N+](=O)[O-])S(F)(F)(F)(F)F
Synonym	4-nitrophenylsulfur pentafluoride,4-nitrophenylsulphur pentafluoride,4-pentafluorosulfur-nitrobenzene,1-nitro-4-pentafluorosulfanyl benzene,1-nitro-4-pentafluoro-??-sulfanyl benzene,acmc-209gok,pentafluoro-4-nitrophenyl,4-pentafluorothio nitrobenzene,4-nitrophenylsulfurpentafluoride,4-nitrophenylpentafluorosulfur vi
IUPAC Name	pentafluoro-(4-nitrophenyl)-$l^{6}-sulfane
InChI Key	AGNCKMHGYZKMLN-UHFFFAOYSA-N
Molecular Formula	C6H4F5NO2S

192

Nitromethane 98.0+%, TCI America™

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

193

Nitrobenzene 99.5+%, TCI America™

CAS: 98-95-3 Molecular Formula: C6H5NO2 Molecular Weight (g/mol): 123.111 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-]

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PubChem CID	7416
CAS	98-95-3
Molecular Weight (g/mol)	123.111
ChEBI	CHEBI:27798
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

194

3-Nitropyridine 98.0+%, TCI America™

CAS: 2530-26-9 Molecular Formula: C5H4N2O2 Molecular Weight (g/mol): 124.10 MDL Number: MFCD00234974 InChI Key: QLILRKBRWXALIE-UHFFFAOYSA-N Synonym: 5-nitropyridine,pyridine, 3-nitro,3-nitro-pyridine,pyridine,3-nitro,pubchem6646,acmc-1cb5f PubChem CID: 137630 IUPAC Name: 3-nitropyridine SMILES: [O-][N+](=O)C1=CC=CN=C1

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Specifications

PubChem CID	137630
CAS	2530-26-9
Molecular Weight (g/mol)	124.10
MDL Number	MFCD00234974
SMILES	[O-][N+](=O)C1=CC=CN=C1
Synonym	5-nitropyridine,pyridine, 3-nitro,3-nitro-pyridine,pyridine,3-nitro,pubchem6646,acmc-1cb5f
IUPAC Name	3-nitropyridine
InChI Key	QLILRKBRWXALIE-UHFFFAOYSA-N
Molecular Formula	C5H4N2O2

195

4-Nitroindole 98.0+%, TCI America™

CAS: 4769-97-5 Molecular Formula: C8H6N2O2 Molecular Weight (g/mol): 162.148 MDL Number: MFCD00010056 InChI Key: LAVZKLJDKGRZJG-UHFFFAOYSA-N Synonym: 4-nitroindole,indole, 4-nitro,1h-indole, 4-nitro,pubchem7440,4-nitro-1 h-indole,#,maybridge1_006408,acmc-209ka5,ksc236o2l PubChem CID: 145766 IUPAC Name: 4-nitro-1H-indole SMILES: C1=CC2=C(C=CN2)C(=C1)[N+](=O)[O-]

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Specifications

PubChem CID	145766
CAS	4769-97-5
Molecular Weight (g/mol)	162.148
MDL Number	MFCD00010056
SMILES	C1=CC2=C(C=CN2)C(=C1)[N+](=O)[O-]
Synonym	4-nitroindole,indole, 4-nitro,1h-indole, 4-nitro,pubchem7440,4-nitro-1 h-indole,#,maybridge1_006408,acmc-209ka5,ksc236o2l
IUPAC Name	4-nitro-1H-indole
InChI Key	LAVZKLJDKGRZJG-UHFFFAOYSA-N
Molecular Formula	C8H6N2O2

Organic oxoazanium compounds

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