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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Nitromethane, 99%, pure

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

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

CAS: 606-21-3 Formula molecolare: C6H3ClN2O4 Molecular Weight (g/mol): 202.55 Numero MDL: MFCD00014689 InChI Key: BPPMIQPXQVIZNJ-UHFFFAOYSA-N Sinonimo: 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

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Sinonimo	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
Numero MDL	MFCD00014689
PubChem CID	11814
Formula molecolare	C6H3ClN2O4
CAS	606-21-3
Molecular Weight (g/mol)	202.55
SMILES	[O-][N+](=O)C1=CC=CC(=C1Cl)[N+]([O-])=O
IUPAC Name	2-chloro-1,3-dinitrobenzene
InChI Key	BPPMIQPXQVIZNJ-UHFFFAOYSA-N

Nitrobenzene, 99%, Extra Pure

CAS: 98-95-3 Formula molecolare: C₆H₅NO₂ Molecular Weight (g/mol): 123.11 Numero MDL: MFCD00007043 InChI Key: LQNUZADURLCDLV-UHFFFAOYSA-N Sinonimo: 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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Sinonimo	nitrobenzol,benzene, nitro,oil of mirbane,mirbane oil,essence of mirbane,nitro-benzene,nitrobenzeen,oil of myrbane,nitrobenzen,mononitrobenzene
Numero MDL	MFCD00007043
PubChem CID	7416
Formula molecolare	C₆H₅NO₂
CAS	98-95-3
Molecular Weight (g/mol)	123.11
ChEBI	CHEBI:27798
SMILES	C1=CC=C(C=C1)[N+](=O)[O-]
IUPAC Name	nitrobenzene
InChI Key	LQNUZADURLCDLV-UHFFFAOYSA-N

4-Nitrophenyl chloroformate, 97%

CAS: 7693-46-1 Formula molecolare: C7H4ClNO4 Molecular Weight (g/mol): 201.562 Numero MDL: MFCD00007321 InChI Key: NXLNNXIXOYSCMB-UHFFFAOYSA-N Sinonimo: 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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Sinonimo	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
Numero MDL	MFCD00007321
PubChem CID	82129
Formula molecolare	C7H4ClNO4
CAS	7693-46-1
Molecular Weight (g/mol)	201.562
SMILES	C1=CC(=CC=C1[N+](=O)[O-])OC(=O)Cl
IUPAC Name	(4-nitrophenyl) carbonochloridate
InChI Key	NXLNNXIXOYSCMB-UHFFFAOYSA-N

1-Chloro-2,4-dinitrobenzene, 99%

CAS: 97-00-7 Formula molecolare: C6H3ClN2O4 Molecular Weight (g/mol): 202.55 Numero MDL: MFCD00007075 InChI Key: VYZAHLCBVHPDDF-UHFFFAOYSA-N Sinonimo: 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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Sinonimo	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
Numero MDL	MFCD00007075
PubChem CID	6
Formula molecolare	C6H3ClN2O4
CAS	97-00-7
Molecular Weight (g/mol)	202.55
ChEBI	CHEBI:34718
SMILES	[O-][N+](=O)C1=CC=C(Cl)C(=C1)[N+]([O-])=O
IUPAC Name	1-chloro-2,4-dinitrobenzene
InChI Key	VYZAHLCBVHPDDF-UHFFFAOYSA-N

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

1,4-Dinitrobenzene, 98+%

CAS: 100-25-4 Formula molecolare: C6H4N2O4 Molecular Weight (g/mol): 168.108 Numero MDL: MFCD00007314 InChI Key: FYFDQJRXFWGIBS-UHFFFAOYSA-N Sinonimo: 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-]

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Sinonimo	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
Numero MDL	MFCD00007314
PubChem CID	7492
Formula molecolare	C6H4N2O4
CAS	100-25-4
Molecular Weight (g/mol)	168.108
ChEBI	CHEBI:51398
SMILES	C1=CC(=CC=C1[N+](=O)[O-])[N+](=O)[O-]
IUPAC Name	1,4-dinitrobenzene
InChI Key	FYFDQJRXFWGIBS-UHFFFAOYSA-N

2,4-Dinitrofluorobenzene, 98%

CAS: 70-34-8 Formula molecolare: C₆H₃FN₂O₄ Molecular Weight (g/mol): 186.1 Numero MDL: MFCD00007056 InChI Key: LOTKRQAVGJMPNV-UHFFFAOYSA-N Sinonimo: 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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Sinonimo	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
Numero MDL	MFCD00007056
PubChem CID	6264
Formula molecolare	C₆H₃FN₂O₄
CAS	70-34-8
Molecular Weight (g/mol)	186.1
ChEBI	CHEBI:53049
SMILES	C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])F
IUPAC Name	1-fluoro-2,4-dinitrobenzene
InChI Key	LOTKRQAVGJMPNV-UHFFFAOYSA-N

1-Fluoro-4-nitrobenzene, 99%

CAS: 350-46-9 Formula molecolare: C6H4FNO2 Molecular Weight (g/mol): 141.101 Numero MDL: MFCD00007282 InChI Key: WFQDTOYDVUWQMS-UHFFFAOYSA-N Sinonimo: 4-fluoronitrobenzene,p-fluoronitrobenzene,p-nitrofluorobenzene,benzene, 1-fluoro-4-nitro,4-nitrofluorobenzene,1-nitro-4-fluorobenzene,4-fluoro-1-nitrobenzene,1-fluoro-4-nitro-benzene,unii-a2m2fh7xhh,p-fluoro nitrobenzene PubChem CID: 9590 IUPAC Name: 1-fluoro-4-nitrobenzene SMILES: C1=CC(=CC=C1[N+](=O)[O-])F

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Sinonimo	4-fluoronitrobenzene,p-fluoronitrobenzene,p-nitrofluorobenzene,benzene, 1-fluoro-4-nitro,4-nitrofluorobenzene,1-nitro-4-fluorobenzene,4-fluoro-1-nitrobenzene,1-fluoro-4-nitro-benzene,unii-a2m2fh7xhh,p-fluoro nitrobenzene
Numero MDL	MFCD00007282
PubChem CID	9590
Formula molecolare	C6H4FNO2
CAS	350-46-9
Molecular Weight (g/mol)	141.101
SMILES	C1=CC(=CC=C1[N+](=O)[O-])F
IUPAC Name	1-fluoro-4-nitrobenzene
InChI Key	WFQDTOYDVUWQMS-UHFFFAOYSA-N

1-Chloro-3-nitrobenzene, 98%

CAS: 121-73-3 Formula molecolare: C6H4ClNO2 Molecular Weight (g/mol): 157.55 Numero MDL: MFCD00007202 InChI Key: KMAQZIILEGKYQZ-UHFFFAOYSA-N Sinonimo: m-chloronitrobenzene,3-nitrochlorobenzene,3-chloronitrobenzene,m-nitrochlorobenzene,benzene, 1-chloro-3-nitro,chloro-m-nitrobenzene,3-chloro-1-nitrobenzene,metachloronitrobenzene,1-chloronitrobenzene,1-nitro-3-chlorobenzene PubChem CID: 8489 ChEBI: CHEBI:82420 IUPAC Name: 1-chloro-3-nitrobenzene SMILES: [O-][N+](=O)C1=CC=CC(Cl)=C1

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Sinonimo	m-chloronitrobenzene,3-nitrochlorobenzene,3-chloronitrobenzene,m-nitrochlorobenzene,benzene, 1-chloro-3-nitro,chloro-m-nitrobenzene,3-chloro-1-nitrobenzene,metachloronitrobenzene,1-chloronitrobenzene,1-nitro-3-chlorobenzene
Numero MDL	MFCD00007202
PubChem CID	8489
Formula molecolare	C6H4ClNO2
CAS	121-73-3
Molecular Weight (g/mol)	157.55
ChEBI	CHEBI:82420
SMILES	[O-][N+](=O)C1=CC=CC(Cl)=C1
IUPAC Name	1-chloro-3-nitrobenzene
InChI Key	KMAQZIILEGKYQZ-UHFFFAOYSA-N

1-Chloro-4-nitrobenzene, 99%

CAS: 100-00-5 Formula molecolare: C₆H₄ClNO₂ Molecular Weight (g/mol): 157.56 Numero MDL: MFCD00007285 InChI Key: CZGCEKJOLUNIFY-UHFFFAOYSA-N Sinonimo: 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

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Sinonimo	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
Numero MDL	MFCD00007285
PubChem CID	7474
Formula molecolare	C₆H₄ClNO₂
CAS	100-00-5
Molecular Weight (g/mol)	157.56
ChEBI	CHEBI:34399
SMILES	C1=CC(=CC=C1[N+](=O)[O-])Cl
IUPAC Name	1-chloro-4-nitrobenzene
InChI Key	CZGCEKJOLUNIFY-UHFFFAOYSA-N

2,6-Dinitrotoluene, 97%

CAS: 606-20-2 Formula molecolare: C7H6N2O4 Molecular Weight (g/mol): 182.135 Numero MDL: MFCD00007158 InChI Key: XTRDKALNCIHHNI-UHFFFAOYSA-N Sinonimo: 2,6-dinitrotoluene,2,6-dnt,benzene, 2-methyl-1,3-dinitro,1-methyl-2,6-dinitrobenzene,2,6-dinitromethylbenzene,toluene, 2,6-dinitro,rcra waste number u106,2-methyl-1,3-dinitro-benzene,unii-gg7fav92mk,ccris 1006 PubChem CID: 11813 ChEBI: CHEBI:957 IUPAC Name: 2-methyl-1,3-dinitrobenzene SMILES: CC1=C(C=CC=C1[N+](=O)[O-])[N+](=O)[O-]

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Sinonimo	2,6-dinitrotoluene,2,6-dnt,benzene, 2-methyl-1,3-dinitro,1-methyl-2,6-dinitrobenzene,2,6-dinitromethylbenzene,toluene, 2,6-dinitro,rcra waste number u106,2-methyl-1,3-dinitro-benzene,unii-gg7fav92mk,ccris 1006
Numero MDL	MFCD00007158
PubChem CID	11813
Formula molecolare	C7H6N2O4
CAS	606-20-2
Molecular Weight (g/mol)	182.135
ChEBI	CHEBI:957
SMILES	CC1=C(C=CC=C1[N+](=O)[O-])[N+](=O)[O-]
IUPAC Name	2-methyl-1,3-dinitrobenzene
InChI Key	XTRDKALNCIHHNI-UHFFFAOYSA-N

4-(4-Nitrobenzyl)pyridine, 98%

CAS: 1083-48-3 Formula molecolare: C12H10N2O2 Molecular Weight (g/mol): 214.22 Numero MDL: MFCD00006445 InChI Key: MNHKUCBXXMFQDM-UHFFFAOYSA-N Sinonimo: 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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Sinonimo	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
Numero MDL	MFCD00006445
PubChem CID	14129
Formula molecolare	C12H10N2O2
CAS	1083-48-3
Molecular Weight (g/mol)	214.22
SMILES	[O-][N+](=O)C1=CC=C(CC2=CC=NC=C2)C=C1
IUPAC Name	4-[(4-nitrophenyl)methyl]pyridine
InChI Key	MNHKUCBXXMFQDM-UHFFFAOYSA-N

2,4-Dichloro-5-nitropyrimidine, 97%

CAS: 49845-33-2 Formula molecolare: C4HCl2N3O2 Molecular Weight (g/mol): 193.97 Numero MDL: MFCD00127867 InChI Key: INUSQTPGSHFGHM-UHFFFAOYSA-N Sinonimo: 2,4-dichloro-5-nitro-pyrimidine,pyrimidine, 2,4-dichloro-5-nitro,2, 4-dichloro-5-nitropyrimidine,3-nitro-2,4-dichloropyrimidine,2,4-dichloro-5-nitro pyrimidine,zlchem 540,pubchem7079,acmc-1ann4,ksc236i7h,2,4-dichloro5-nitropyrimidine PubChem CID: 521266 IUPAC Name: 2,4-dichloro-5-nitropyrimidine SMILES: [O-][N+](=O)C1=CN=C(Cl)N=C1Cl

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Sinonimo	2,4-dichloro-5-nitro-pyrimidine,pyrimidine, 2,4-dichloro-5-nitro,2, 4-dichloro-5-nitropyrimidine,3-nitro-2,4-dichloropyrimidine,2,4-dichloro-5-nitro pyrimidine,zlchem 540,pubchem7079,acmc-1ann4,ksc236i7h,2,4-dichloro5-nitropyrimidine
Numero MDL	MFCD00127867
PubChem CID	521266
Formula molecolare	C4HCl2N3O2
CAS	49845-33-2
Molecular Weight (g/mol)	193.97
SMILES	[O-][N+](=O)C1=CN=C(Cl)N=C1Cl
IUPAC Name	2,4-dichloro-5-nitropyrimidine
InChI Key	INUSQTPGSHFGHM-UHFFFAOYSA-N

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

CAS: 610-93-5 Formula molecolare: C8H5NO4 Molecular Weight (g/mol): 179.13 Numero MDL: MFCD00033529 InChI Key: RNWGZXAHUPFXLL-UHFFFAOYSA-N Sinonimo: 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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Sinonimo	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
Numero MDL	MFCD00033529
PubChem CID	223584
Formula molecolare	C8H5NO4
CAS	610-93-5
Molecular Weight (g/mol)	179.13
SMILES	[O-][N+](=O)C1=CC=C2COC(=O)C2=C1
IUPAC Name	6-nitro-1,3-dihydro-2-benzofuran-1-one
InChI Key	RNWGZXAHUPFXLL-UHFFFAOYSA-N

Organic oxoazanium compounds

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