Organic oxoazanium compounds

Organic oxoazanium compounds
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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 |
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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 |
3-Nitropyridine, 98%
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
PubChem CID | 137630 |
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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 |
4-Nitrobenzyl chloroformate, 95%
CAS: 4457-32-3 Molecular Formula: C8H6ClNO4 Molecular Weight (g/mol): 215.59 MDL Number: MFCD00007375 InChI Key: MHSGOABISYIYKP-UHFFFAOYSA-N Synonym: 4-nitrobenzyl chloroformate,4-nitrobenzyl carbonochloridate,carbonochloridic acid, 4-nitrophenyl methyl ester,4-nitrobenzyl chlorocarbonate,p-nitrobenzyl chloroformate,4-nitrocarbobenzoxychloride,4-nitrophenyl methyl chloroformate,p-nitrobenzyloxycarbonyl chloride,4-nitrobenzyloxycarbonyl chloride,chloroformic acid p-nitrobenzyl ester PubChem CID: 78205 IUPAC Name: (4-nitrophenyl)methyl carbonochloridate SMILES: C1=CC(=CC=C1COC(=O)Cl)[N+](=O)[O-]
PubChem CID | 78205 |
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CAS | 4457-32-3 |
Molecular Weight (g/mol) | 215.59 |
MDL Number | MFCD00007375 |
SMILES | C1=CC(=CC=C1COC(=O)Cl)[N+](=O)[O-] |
Synonym | 4-nitrobenzyl chloroformate,4-nitrobenzyl carbonochloridate,carbonochloridic acid, 4-nitrophenyl methyl ester,4-nitrobenzyl chlorocarbonate,p-nitrobenzyl chloroformate,4-nitrocarbobenzoxychloride,4-nitrophenyl methyl chloroformate,p-nitrobenzyloxycarbonyl chloride,4-nitrobenzyloxycarbonyl chloride,chloroformic acid p-nitrobenzyl ester |
IUPAC Name | (4-nitrophenyl)methyl carbonochloridate |
InChI Key | MHSGOABISYIYKP-UHFFFAOYSA-N |
Molecular Formula | C8H6ClNO4 |
5-Chloro-2,4-dinitrotoluene, 97%
CAS: 51676-74-5 Molecular Formula: C7H5ClN2O4 Molecular Weight (g/mol): 216.577 MDL Number: MFCD00041235 InChI Key: KPDPGZNHKMJEFZ-UHFFFAOYSA-N Synonym: 5-chloro-2,4-dinitrotoluene,toluene, 5-chloro-2,4-dinitro,1-chloro-5-methyl-2,4-dinitro-benzene,2-chloro-4-methyl-1,5-dinitrobenzene,acmc-20am4s,5-chlor-2.4-dinitrotoluol,benzene,1-chloro-5-methyl-2,4-dinitro,1-chloranyl-5-methyl-2,4-dinitro-benzene PubChem CID: 253802 IUPAC Name: 1-chloro-5-methyl-2,4-dinitrobenzene SMILES: CC1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])Cl
PubChem CID | 253802 |
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CAS | 51676-74-5 |
Molecular Weight (g/mol) | 216.577 |
MDL Number | MFCD00041235 |
SMILES | CC1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])Cl |
Synonym | 5-chloro-2,4-dinitrotoluene,toluene, 5-chloro-2,4-dinitro,1-chloro-5-methyl-2,4-dinitro-benzene,2-chloro-4-methyl-1,5-dinitrobenzene,acmc-20am4s,5-chlor-2.4-dinitrotoluol,benzene,1-chloro-5-methyl-2,4-dinitro,1-chloranyl-5-methyl-2,4-dinitro-benzene |
IUPAC Name | 1-chloro-5-methyl-2,4-dinitrobenzene |
InChI Key | KPDPGZNHKMJEFZ-UHFFFAOYSA-N |
Molecular Formula | C7H5ClN2O4 |
2,6-Dinitrobenzonitrile, 98+%
CAS: 35213-00-4 Molecular Formula: C7H3N3O4 Molecular Weight (g/mol): 193.118 MDL Number: MFCD00041246 InChI Key: ZYDGHQSJZAFMLU-UHFFFAOYSA-N Synonym: dinitrobenzonitrile,benzonitrile, 2,6-dinitro,2,6-dinitro-benzonitrile,2,6-dinitrobenzenecarbonitrile,2,6-dinitrobenznitrile,pubchem21108,2.6-dinitrobenzonitril,2,6 dinitrobenzonitrile,2,6-dini trobenzonitrile,acmc-1ad1y PubChem CID: 520718 IUPAC Name: 2,6-dinitrobenzonitrile SMILES: C1=CC(=C(C(=C1)[N+](=O)[O-])C#N)[N+](=O)[O-]
PubChem CID | 520718 |
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CAS | 35213-00-4 |
Molecular Weight (g/mol) | 193.118 |
MDL Number | MFCD00041246 |
SMILES | C1=CC(=C(C(=C1)[N+](=O)[O-])C#N)[N+](=O)[O-] |
Synonym | dinitrobenzonitrile,benzonitrile, 2,6-dinitro,2,6-dinitro-benzonitrile,2,6-dinitrobenzenecarbonitrile,2,6-dinitrobenznitrile,pubchem21108,2.6-dinitrobenzonitril,2,6 dinitrobenzonitrile,2,6-dini trobenzonitrile,acmc-1ad1y |
IUPAC Name | 2,6-dinitrobenzonitrile |
InChI Key | ZYDGHQSJZAFMLU-UHFFFAOYSA-N |
Molecular Formula | C7H3N3O4 |
Nitromethane, 99+%, for analysis
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 |
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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 |
Nitromethane, 96%, for HPLC
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 |
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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 |
1-Chloro-2,4-dinitrobenzene, 99%
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
PubChem CID | 6 |
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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 |
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 |
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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 |
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 |
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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 |
Ethyl 5-nitroindole-2-carboxylate, 95%
CAS: 16732-57-3 Molecular Formula: C11H10N2O4 Molecular Weight (g/mol): 234.21 MDL Number: MFCD00216477 InChI Key: DVFJMQCNICEPAI-UHFFFAOYSA-N Synonym: ethyl 5-nitroindole-2-carboxylate,ethyl-5-nitroindole-2-carboxylate,5-nitroindole-2-carboxylic acid ethyl ester,ethyl-5-nitro-1h-indole-carboxylate,1h-indole-2-carboxylic acid, 5-nitro-, ethyl ester,2-ethoxycarbonyl-5-nitroindole,2-ethoxycarbonyl-5-nitro-1h-indole,labotest-bb lt00441291,pubchem3016,acmc-209dw7 PubChem CID: 280312 IUPAC Name: ethyl 5-nitro-1H-indole-2-carboxylate SMILES: CCOC(=O)C1=CC2=CC(=CC=C2N1)[N+]([O-])=O
PubChem CID | 280312 |
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CAS | 16732-57-3 |
Molecular Weight (g/mol) | 234.21 |
MDL Number | MFCD00216477 |
SMILES | CCOC(=O)C1=CC2=CC(=CC=C2N1)[N+]([O-])=O |
Synonym | ethyl 5-nitroindole-2-carboxylate,ethyl-5-nitroindole-2-carboxylate,5-nitroindole-2-carboxylic acid ethyl ester,ethyl-5-nitro-1h-indole-carboxylate,1h-indole-2-carboxylic acid, 5-nitro-, ethyl ester,2-ethoxycarbonyl-5-nitroindole,2-ethoxycarbonyl-5-nitro-1h-indole,labotest-bb lt00441291,pubchem3016,acmc-209dw7 |
IUPAC Name | ethyl 5-nitro-1H-indole-2-carboxylate |
InChI Key | DVFJMQCNICEPAI-UHFFFAOYSA-N |
Molecular Formula | C11H10N2O4 |
Nitrobenzene, 99+%, ACS reagent
CAS: 98-95-3 Molecular Formula: C6H5NO2 Molecular Weight (g/mol): 123.11 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 |
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CAS | 98-95-3 |
Molecular Weight (g/mol) | 123.11 |
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 |
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 |
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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 |
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 |
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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 |
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 |
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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 |