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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121 – 135 of 652 results

121

2,4-Dinitrofluorobenzene 99.0+%, TCI America™

CAS: 70-34-8 Molecular Formula: C6H3FN2O4 Molecular Weight (g/mol): 186.098 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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PubChem CID	6264
CAS	70-34-8
Molecular Weight (g/mol)	186.098
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

122

1-Chloro-2,4-dinitrobenzene 99.0+%, TCI America™

CAS: 97-00-7 Molecular Formula: C6H3ClN2O4 Molecular Weight (g/mol): 202.55 MDL Number: MFCD00007075 InChI Key: VYZAHLCBVHPDDF-UHFFFAOYSA-N Synonym: 2,4-dinitrochlorobenzene,dinitrochlorobenzene,dncb,cdnb,chlorodinitrobenzene,4-chloro-1,3-dinitrobenzene,2,4-dinitrophenyl chloride,benzene, 1-chloro-2,4-dinitro,dinitrochlorobenzol,1,3-dinitro-4-chlorobenzene PubChem CID: 6 ChEBI: CHEBI:34718 IUPAC Name: 1-chloro-2,4-dinitrobenzene SMILES: [O-][N+](=O)C1=CC=C(Cl)C(=C1)[N+]([O-])=O

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Specifications

PubChem CID	6
CAS	97-00-7
Molecular Weight (g/mol)	202.55
ChEBI	CHEBI:34718
MDL Number	MFCD00007075
SMILES	[O-][N+](=O)C1=CC=C(Cl)C(=C1)[N+]([O-])=O
Synonym	2,4-dinitrochlorobenzene,dinitrochlorobenzene,dncb,cdnb,chlorodinitrobenzene,4-chloro-1,3-dinitrobenzene,2,4-dinitrophenyl chloride,benzene, 1-chloro-2,4-dinitro,dinitrochlorobenzol,1,3-dinitro-4-chlorobenzene
IUPAC Name	1-chloro-2,4-dinitrobenzene
InChI Key	VYZAHLCBVHPDDF-UHFFFAOYSA-N
Molecular Formula	C6H3ClN2O4

123

Ethyl 4-Nitrophenylacetate 98.0+%, TCI America™

CAS: 5445-26-1 Molecular Formula: C10H11NO4 Molecular Weight (g/mol): 209.20 MDL Number: MFCD00017046 InChI Key: DWDRNKYLWMKWTH-UHFFFAOYSA-N Synonym: ethyl 4-nitrophenylacetate,ethyl 2-4-nitrophenyl acetate,ethyl p-nitrophenylacetate,ethyl 4-nitrobenzeneacetate,ethyl 4-nitrophenyl acetate,4-nitrophenylacetic acid ethyl ester,benzeneacetic acid, 4-nitro-, ethyl ester,ethyl-4-nitrophenylacetate,acetic acid, p-nitrophenyl-, ethyl ester,4-nitro-phenyl-acetic acid ethyl ester PubChem CID: 79517 IUPAC Name: ethyl 2-(4-nitrophenyl)acetate SMILES: CCOC(=O)CC1=CC=C(C=C1)[N+]([O-])=O

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Specifications

PubChem CID	79517
CAS	5445-26-1
Molecular Weight (g/mol)	209.20
MDL Number	MFCD00017046
SMILES	CCOC(=O)CC1=CC=C(C=C1)[N+]([O-])=O
Synonym	ethyl 4-nitrophenylacetate,ethyl 2-4-nitrophenyl acetate,ethyl p-nitrophenylacetate,ethyl 4-nitrobenzeneacetate,ethyl 4-nitrophenyl acetate,4-nitrophenylacetic acid ethyl ester,benzeneacetic acid, 4-nitro-, ethyl ester,ethyl-4-nitrophenylacetate,acetic acid, p-nitrophenyl-, ethyl ester,4-nitro-phenyl-acetic acid ethyl ester
IUPAC Name	ethyl 2-(4-nitrophenyl)acetate
InChI Key	DWDRNKYLWMKWTH-UHFFFAOYSA-N
Molecular Formula	C10H11NO4

124

4-Chloro-3,5-dinitrobenzonitrile 98.0+%, TCI America™

CAS: 1930-72-9 Molecular Formula: C7H2ClN3O4 Molecular Weight (g/mol): 227.56 MDL Number: MFCD00007067 InChI Key: SCGDEDHSPCXGEC-UHFFFAOYSA-N Synonym: benzonitrile, 4-chloro-3,5-dinitro,4-chloro-3,5-dinitrobenzenenitrile,1-chloro-4-cyano-2,6-dinitrobenzene,4-chloro-3,5-dinitrobenzenecarbonitrile,acmc-1brcu,4-chloro-3,5-dinitrobenzonitril,3,5-dinitro-4-chlorobenzonitrile,4-cyano-2,6-dinitrochlorobenzene,4-chloro-3,5-dinitro-benzonitrile,benzonitrile,4-chloro-3,5-dinitro PubChem CID: 16008 IUPAC Name: 4-chloro-3,5-dinitrobenzonitrile SMILES: C1=C(C=C(C(=C1[N+](=O)[O-])Cl)[N+](=O)[O-])C#N

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Specifications

PubChem CID	16008
CAS	1930-72-9
Molecular Weight (g/mol)	227.56
MDL Number	MFCD00007067
SMILES	C1=C(C=C(C(=C1[N+](=O)[O-])Cl)[N+](=O)[O-])C#N
Synonym	benzonitrile, 4-chloro-3,5-dinitro,4-chloro-3,5-dinitrobenzenenitrile,1-chloro-4-cyano-2,6-dinitrobenzene,4-chloro-3,5-dinitrobenzenecarbonitrile,acmc-1brcu,4-chloro-3,5-dinitrobenzonitril,3,5-dinitro-4-chlorobenzonitrile,4-cyano-2,6-dinitrochlorobenzene,4-chloro-3,5-dinitro-benzonitrile,benzonitrile,4-chloro-3,5-dinitro
IUPAC Name	4-chloro-3,5-dinitrobenzonitrile
InChI Key	SCGDEDHSPCXGEC-UHFFFAOYSA-N
Molecular Formula	C7H2ClN3O4

125

3-Nitroaniline 98.0+%, TCI America™

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

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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

126

2,3-Dimethyl-2,3-dinitrobutane 98.0+%, TCI America™

CAS: 3964-18-9 Molecular Formula: C6H12N2O4 Molecular Weight (g/mol): 176.172 MDL Number: MFCD00007392 InChI Key: DWCLXOREGBLXTD-UHFFFAOYSA-N PubChem CID: 77577 IUPAC Name: 2,3-dimethyl-2,3-dinitrobutane SMILES: CC(C)(C(C)(C)[N+](=O)[O-])[N+](=O)[O-]

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Specifications

PubChem CID	77577
CAS	3964-18-9
Molecular Weight (g/mol)	176.172
MDL Number	MFCD00007392
SMILES	CC(C)(C(C)(C)[N+](=O)[O-])[N+](=O)[O-]
IUPAC Name	2,3-dimethyl-2,3-dinitrobutane
InChI Key	DWCLXOREGBLXTD-UHFFFAOYSA-N
Molecular Formula	C6H12N2O4

127

2,3-Dichloronitrobenzene 99.0+%, TCI America™

CAS: 3209-22-1 Molecular Formula: C6H3Cl2NO2 Molecular Weight (g/mol): 191.995 MDL Number: MFCD00007062 InChI Key: CMVQZRLQEOAYSW-UHFFFAOYSA-N Synonym: 2,3-dichloronitrobenzene,2,3-dichloro-1-nitrobenzene,benzene, 1,2-dichloro-3-nitro,benzene, dichloronitro,unii-985ews35kg,ccris 5901,pubchem10770,acmc-1ccaw,2,3 dichloronitrobenzene,dichloronitrobenzene PubChem CID: 18555 IUPAC Name: 1,2-dichloro-3-nitrobenzene SMILES: C1=CC(=C(C(=C1)Cl)Cl)[N+](=O)[O-]

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Specifications

PubChem CID	18555
CAS	3209-22-1
Molecular Weight (g/mol)	191.995
MDL Number	MFCD00007062
SMILES	C1=CC(=C(C(=C1)Cl)Cl)[N+](=O)[O-]
Synonym	2,3-dichloronitrobenzene,2,3-dichloro-1-nitrobenzene,benzene, 1,2-dichloro-3-nitro,benzene, dichloronitro,unii-985ews35kg,ccris 5901,pubchem10770,acmc-1ccaw,2,3 dichloronitrobenzene,dichloronitrobenzene
IUPAC Name	1,2-dichloro-3-nitrobenzene
InChI Key	CMVQZRLQEOAYSW-UHFFFAOYSA-N
Molecular Formula	C6H3Cl2NO2

128

1-Chloro-4-fluoro-2-nitrobenzene 98.0+%, TCI America™

CAS: 345-17-5 Molecular Formula: C6H3ClFNO2 Molecular Weight (g/mol): 175.54 MDL Number: MFCD00084853 InChI Key: DVXDJQKEEKXJBW-UHFFFAOYSA-N Synonym: 2-chloro-5-fluoronitrobenzene,benzene, 1-chloro-4-fluoro-2-nitro,pubchem1049,ksc497k7f,1-chloro-4-fluoronitrobenzene,2-chloro-5-fiuoronitrobenzene,2-chloro-5-fluoro-nitrobenzene,2-chloro-5-fluoronitro-benzene,ablock ab-13-8500,1-chloro-4-fluoro-2-nitro-benzene PubChem CID: 67659 IUPAC Name: 1-chloro-4-fluoro-2-nitrobenzene SMILES: [O-][N+](=O)C1=CC(F)=CC=C1Cl

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PubChem CID	67659
CAS	345-17-5
Molecular Weight (g/mol)	175.54
MDL Number	MFCD00084853
SMILES	[O-][N+](=O)C1=CC(F)=CC=C1Cl
Synonym	2-chloro-5-fluoronitrobenzene,benzene, 1-chloro-4-fluoro-2-nitro,pubchem1049,ksc497k7f,1-chloro-4-fluoronitrobenzene,2-chloro-5-fiuoronitrobenzene,2-chloro-5-fluoro-nitrobenzene,2-chloro-5-fluoronitro-benzene,ablock ab-13-8500,1-chloro-4-fluoro-2-nitro-benzene
IUPAC Name	1-chloro-4-fluoro-2-nitrobenzene
InChI Key	DVXDJQKEEKXJBW-UHFFFAOYSA-N
Molecular Formula	C6H3ClFNO2

129

2,6-Difluoronitrobenzene 98.0+%, TCI America™

CAS: 19064-24-5 Molecular Formula: C6H3F2NO2 Molecular Weight (g/mol): 159.092 MDL Number: MFCD00192035 InChI Key: SSNCMIDZGFCTST-UHFFFAOYSA-N Synonym: 2,6-difluoronitrobenzene,1,3-difluoro-2-nitro-benzene,benzene, 1,3-difluoro-2-nitro,2,6-difluoro nitrobenzene,pubchem4403,1,3-difluoronitrobenzene,acmc-1buv1,2,6-difluoro-nitrobenzene,2,6-difluoro nitro benzene,1,3-difluoro-2-nitrobenzen PubChem CID: 87922 IUPAC Name: 1,3-difluoro-2-nitrobenzene SMILES: C1=CC(=C(C(=C1)F)[N+](=O)[O-])F

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Specifications

PubChem CID	87922
CAS	19064-24-5
Molecular Weight (g/mol)	159.092
MDL Number	MFCD00192035
SMILES	C1=CC(=C(C(=C1)F)[N+](=O)[O-])F
Synonym	2,6-difluoronitrobenzene,1,3-difluoro-2-nitro-benzene,benzene, 1,3-difluoro-2-nitro,2,6-difluoro nitrobenzene,pubchem4403,1,3-difluoronitrobenzene,acmc-1buv1,2,6-difluoro-nitrobenzene,2,6-difluoro nitro benzene,1,3-difluoro-2-nitrobenzen
IUPAC Name	1,3-difluoro-2-nitrobenzene
InChI Key	SSNCMIDZGFCTST-UHFFFAOYSA-N
Molecular Formula	C6H3F2NO2

130

1,3,5-Trinitrobenzene (wetted with ca. 40% Water) (unit weight on dry weight basis) 98.0+%, TCI America™

CAS: 99-35-4 Molecular Formula: C6H3N3O6 Molecular Weight (g/mol): 213.105 MDL Number: MFCD00059179 InChI Key: UATJOMSPNYCXIX-UHFFFAOYSA-N Synonym: trinitrobenzene,sym-trinitrobenzene,s-trinitrobenzene,benzite,syn-trinitrobenzene,trinitrobenzeen,trinitrobenzol,benzene, 1,3,5-trinitro,benzene, trinitro-wet,rcra waste number u234 PubChem CID: 7434 ChEBI: CHEBI:48113 IUPAC Name: 1,3,5-trinitrobenzene SMILES: C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

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Specifications

PubChem CID	7434
CAS	99-35-4
Molecular Weight (g/mol)	213.105
ChEBI	CHEBI:48113
MDL Number	MFCD00059179
SMILES	C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]
Synonym	trinitrobenzene,sym-trinitrobenzene,s-trinitrobenzene,benzite,syn-trinitrobenzene,trinitrobenzeen,trinitrobenzol,benzene, 1,3,5-trinitro,benzene, trinitro-wet,rcra waste number u234
IUPAC Name	1,3,5-trinitrobenzene
InChI Key	UATJOMSPNYCXIX-UHFFFAOYSA-N
Molecular Formula	C6H3N3O6

131

3-Nitropyrrole 98.0+%, TCI America™

CAS: 5930-94-9 Molecular Formula: C4H4N2O2 Molecular Weight (g/mol): 112.088 MDL Number: MFCD00059714 InChI Key: LOJNBPNACKZWAI-UHFFFAOYSA-N PubChem CID: 145813 IUPAC Name: 3-nitro-1H-pyrrole SMILES: C1=CNC=C1[N+](=O)[O-]

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Specifications

PubChem CID	145813
CAS	5930-94-9
Molecular Weight (g/mol)	112.088
MDL Number	MFCD00059714
SMILES	C1=CNC=C1[N+](=O)[O-]
IUPAC Name	3-nitro-1H-pyrrole
InChI Key	LOJNBPNACKZWAI-UHFFFAOYSA-N
Molecular Formula	C4H4N2O2

132

3-Nitrophthalonitrile 98.0+%, TCI America™

CAS: 51762-67-5 Molecular Formula: C8H3N3O2 Molecular Weight (g/mol): 173.13 MDL Number: MFCD00191558 InChI Key: UZJZIZFCQFZDHP-UHFFFAOYSA-N Synonym: 3-nitrophthalonitrile,2,3-dicyanonitrobenzene,1,2-benzenedicarbonitrile, 3-nitro,3-nitrophthalodinitrile,1,2-dicyano-3-nitrobenzene,3-nitro-1,2-benzenedicarbonitrile,nitrophthalonitrile,3-nitro-phthalonitrile,3-nitrophthalonitrile?,acmc-209kvo PubChem CID: 162652 IUPAC Name: 3-nitrobenzene-1,2-dicarbonitrile SMILES: [O-][N+](=O)C1=CC=CC(C#N)=C1C#N

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Specifications

PubChem CID	162652
CAS	51762-67-5
Molecular Weight (g/mol)	173.13
MDL Number	MFCD00191558
SMILES	[O-][N+](=O)C1=CC=CC(C#N)=C1C#N
Synonym	3-nitrophthalonitrile,2,3-dicyanonitrobenzene,1,2-benzenedicarbonitrile, 3-nitro,3-nitrophthalodinitrile,1,2-dicyano-3-nitrobenzene,3-nitro-1,2-benzenedicarbonitrile,nitrophthalonitrile,3-nitro-phthalonitrile,3-nitrophthalonitrile?,acmc-209kvo
IUPAC Name	3-nitrobenzene-1,2-dicarbonitrile
InChI Key	UZJZIZFCQFZDHP-UHFFFAOYSA-N
Molecular Formula	C8H3N3O2

133

2,4-Dinitrophenylsulfenyl Chloride 96.0+%, TCI America™

CAS: 528-76-7 Molecular Formula: C6H3ClN2O4S Molecular Weight (g/mol): 234.61 MDL Number: MFCD00007129 InChI Key: GPXDNWQSQHFKRB-UHFFFAOYSA-N Synonym: 2,4-Dinitrobenzenesulfenyl Chloride PubChem CID: 68251 IUPAC Name: (2,4-dinitrophenyl) thiohypochlorite SMILES: C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])SCl

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Specifications

PubChem CID	68251
CAS	528-76-7
Molecular Weight (g/mol)	234.61
MDL Number	MFCD00007129
SMILES	C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])SCl
Synonym	2,4-Dinitrobenzenesulfenyl Chloride
IUPAC Name	(2,4-dinitrophenyl) thiohypochlorite
InChI Key	GPXDNWQSQHFKRB-UHFFFAOYSA-N
Molecular Formula	C6H3ClN2O4S

134

2,4,6-Trifluoronitrobenzene 97.0+%, TCI America™

CAS: 315-14-0 Molecular Formula: C6H2F3NO2 Molecular Weight (g/mol): 177.082 MDL Number: MFCD00014687 InChI Key: PWRFDGYYJWQIAB-UHFFFAOYSA-N Synonym: 2,4,6-trifluoronitrobenzene,2,2,6-trifluoronitrobenzene,benzene, 1,3,5-trifluoro-2-nitro,1,3,5-trifluoro-2-nitro-benzene,2-nitro-1,3,5-trifluorobenzene,pubchem10646,acmc-209hn4,1,3,5-trifluoronitrobenzene,2,4,6 trifluoronitrobenzene,ksc226o4t PubChem CID: 67567 IUPAC Name: 1,3,5-trifluoro-2-nitrobenzene SMILES: C1=C(C=C(C(=C1F)[N+](=O)[O-])F)F

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Specifications

PubChem CID	67567
CAS	315-14-0
Molecular Weight (g/mol)	177.082
MDL Number	MFCD00014687
SMILES	C1=C(C=C(C(=C1F)[N+](=O)[O-])F)F
Synonym	2,4,6-trifluoronitrobenzene,2,2,6-trifluoronitrobenzene,benzene, 1,3,5-trifluoro-2-nitro,1,3,5-trifluoro-2-nitro-benzene,2-nitro-1,3,5-trifluorobenzene,pubchem10646,acmc-209hn4,1,3,5-trifluoronitrobenzene,2,4,6 trifluoronitrobenzene,ksc226o4t
IUPAC Name	1,3,5-trifluoro-2-nitrobenzene
InChI Key	PWRFDGYYJWQIAB-UHFFFAOYSA-N
Molecular Formula	C6H2F3NO2

135

3-Nitrophthalic Anhydride 97.0+%, TCI America™

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-1,3-dihydro-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-1,3-dihydro-2-benzofuran-1,3-dione
InChI Key	ROFZMKDROVBLNY-UHFFFAOYSA-N
Molecular Formula	C8H3NO5

Organic oxoazanium compounds

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