Nitrobenzoic acids and derivatives

Nitrobenzoic acids and derivatives
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MilliporeSigma™ 5,5'-Dithio-bis-(2-nitrobenzoic Acid), Calbiochem™,
CAS: 69-78-3 Formule moléculaire: C14H8N2O8S2 Poids moléculaire (g/mol): 396.34 Numéro MDL: MFCD00007140 Clé InChI: KIUMMUBSPKGMOY-UHFFFAOYSA-N Synonyme: dtnb,5,5'-dithiobis 2-nitrobenzoic acid,ellman's reagent,3-carboxy-4-nitrophenyl disulfide,dithionitrobenzoic acid,dithiobisnitrobenzoic acid,5,5'-disulfanediylbis 2-nitrobenzoic acid,benzoic acid, 3,3'-dithiobis 6-nitro,3,3'-dithiobis 6-nitrobenzoic acid,5,5'-dithio-bis 2-nitrobenzoic acid CID PubChem: 6254 ChEBI: CHEBI:86228 Nom IUPAC: 5-[(3-carboxy-4-nitrophenyl)disulfanyl]-2-nitrobenzoic acid SMILES: OC(=O)C1=CC(SSC2=CC=C(C(=C2)C(O)=O)[N+]([O-])=O)=CC=C1[N+]([O-])=O
Poids moléculaire (g/mol) | 396.34 |
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Synonyme | dtnb,5,5'-dithiobis 2-nitrobenzoic acid,ellman's reagent,3-carboxy-4-nitrophenyl disulfide,dithionitrobenzoic acid,dithiobisnitrobenzoic acid,5,5'-disulfanediylbis 2-nitrobenzoic acid,benzoic acid, 3,3'-dithiobis 6-nitro,3,3'-dithiobis 6-nitrobenzoic acid,5,5'-dithio-bis 2-nitrobenzoic acid |
Numéro MDL | MFCD00007140 |
CAS | 69-78-3 |
CID PubChem | 6254 |
ChEBI | CHEBI:86228 |
Nom IUPAC | 5-[(3-carboxy-4-nitrophenyl)disulfanyl]-2-nitrobenzoic acid |
Clé InChI | KIUMMUBSPKGMOY-UHFFFAOYSA-N |
SMILES | OC(=O)C1=CC(SSC2=CC=C(C(=C2)C(O)=O)[N+]([O-])=O)=CC=C1[N+]([O-])=O |
Formule moléculaire | C14H8N2O8S2 |
Methyl 3-fluoro-4-nitrobenzoate, 97%
CAS: 185629-31-6 Formule moléculaire: C8H6FNO4 Poids moléculaire (g/mol): 199.137 Numéro MDL: MFCD08444027 Clé InChI: FKMZNQQOPCCUTD-UHFFFAOYSA-N CID PubChem: 592761 Nom IUPAC: methyl 3-fluoro-4-nitrobenzoate SMILES: COC(=O)C1=CC(=C(C=C1)[N+](=O)[O-])F
Poids moléculaire (g/mol) | 199.137 |
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Numéro MDL | MFCD08444027 |
CAS | 185629-31-6 |
CID PubChem | 592761 |
Nom IUPAC | methyl 3-fluoro-4-nitrobenzoate |
Clé InChI | FKMZNQQOPCCUTD-UHFFFAOYSA-N |
SMILES | COC(=O)C1=CC(=C(C=C1)[N+](=O)[O-])F |
Formule moléculaire | C8H6FNO4 |
2-Amino-4-nitrobenzoic acid, 97+%
CAS: 619-17-0 Formule moléculaire: C7H6N2O4 Poids moléculaire (g/mol): 182.14 Numéro MDL: MFCD00007262 Clé InChI: UEALKTCRMBVTFN-UHFFFAOYSA-N Synonyme: 2-amino-4-nitrobenzoic acid,4-nitroanthranilic acid,benzoic acid, 2-amino-4-nitro,2-amino-4-nitrobenzoicacid,anthranilic acid, 4-nitro,ccris 441,2-amino-4-nitro-benzoic acid,4-nitro-2-aminobenzoic acid,dsstox_cid_963,dsstox_rid_75891 CID PubChem: 12076 ChEBI: CHEBI:75335 Nom IUPAC: 2-amino-4-nitrobenzoic acid SMILES: NC1=CC(=CC=C1C(O)=O)[N+]([O-])=O
Poids moléculaire (g/mol) | 182.14 |
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Synonyme | 2-amino-4-nitrobenzoic acid,4-nitroanthranilic acid,benzoic acid, 2-amino-4-nitro,2-amino-4-nitrobenzoicacid,anthranilic acid, 4-nitro,ccris 441,2-amino-4-nitro-benzoic acid,4-nitro-2-aminobenzoic acid,dsstox_cid_963,dsstox_rid_75891 |
Numéro MDL | MFCD00007262 |
CAS | 619-17-0 |
CID PubChem | 12076 |
ChEBI | CHEBI:75335 |
Nom IUPAC | 2-amino-4-nitrobenzoic acid |
Clé InChI | UEALKTCRMBVTFN-UHFFFAOYSA-N |
SMILES | NC1=CC(=CC=C1C(O)=O)[N+]([O-])=O |
Formule moléculaire | C7H6N2O4 |
2-Amino-6-nitrobenzoic acid, 97%
CAS: 50573-74-5 Formule moléculaire: C7H6N2O4 Poids moléculaire (g/mol): 182.135 Numéro MDL: MFCD00034785 Clé InChI: GGKYLHNARFFORH-UHFFFAOYSA-N Synonyme: 2-amino-6-nitrobenzoic acid,benzoic acid, 2-amino-6-nitro,6-nitroanthranilic acid,2-amino-6-nitro-benzoic acid,2-amino-6-nitrobenzoicacid,6-nitroanthanilic acid,acmc-209knw,6-nitro-anthranilic acid,6-nitro-2-aminobenzoesaure,ksc911o8d CID PubChem: 95795 SMILES: C1=CC(=C(C(=C1)[N+](=O)[O-])C(=O)O)N
Poids moléculaire (g/mol) | 182.135 |
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Synonyme | 2-amino-6-nitrobenzoic acid,benzoic acid, 2-amino-6-nitro,6-nitroanthranilic acid,2-amino-6-nitro-benzoic acid,2-amino-6-nitrobenzoicacid,6-nitroanthanilic acid,acmc-209knw,6-nitro-anthranilic acid,6-nitro-2-aminobenzoesaure,ksc911o8d |
Numéro MDL | MFCD00034785 |
CAS | 50573-74-5 |
CID PubChem | 95795 |
Clé InChI | GGKYLHNARFFORH-UHFFFAOYSA-N |
SMILES | C1=CC(=C(C(=C1)[N+](=O)[O-])C(=O)O)N |
Formule moléculaire | C7H6N2O4 |
2,6-Dimethoxy-3-nitrobenzoic acid, 97%
CAS: 55776-17-5 Formule moléculaire: C9H9NO6 Poids moléculaire (g/mol): 227.172 Numéro MDL: MFCD00017324 Clé InChI: YIKBQFPTPKEFSM-UHFFFAOYSA-N Synonyme: 2,6-dimethoxy-3-nitro-benzoic acid,acmc-20ao8d,benzoic acid, 2,6-dimethoxy-3-nitro CID PubChem: 3085094 Nom IUPAC: 2,6-dimethoxy-3-nitrobenzoic acid SMILES: COC1=C(C(=C(C=C1)[N+](=O)[O-])OC)C(=O)O
Poids moléculaire (g/mol) | 227.172 |
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Synonyme | 2,6-dimethoxy-3-nitro-benzoic acid,acmc-20ao8d,benzoic acid, 2,6-dimethoxy-3-nitro |
Numéro MDL | MFCD00017324 |
CAS | 55776-17-5 |
CID PubChem | 3085094 |
Nom IUPAC | 2,6-dimethoxy-3-nitrobenzoic acid |
Clé InChI | YIKBQFPTPKEFSM-UHFFFAOYSA-N |
SMILES | COC1=C(C(=C(C=C1)[N+](=O)[O-])OC)C(=O)O |
Formule moléculaire | C9H9NO6 |
Methyl 3-methoxy-2-nitrobenzoate, 98%, Thermo Scientific Chemicals
CAS: 5307-17-5 Formule moléculaire: C9H9NO5 Poids moléculaire (g/mol): 211.17 Numéro MDL: MFCD00051968 Clé InChI: FDQQRLPHAAICCR-UHFFFAOYSA-N Synonyme: benzoic acid, 3-methoxy-2-nitro-, methyl ester,3-methoxy-2-nitrobenzoic acid methyl ester,m-anisic acid, 2-nitro-, methyl ester,maybridge1_002124,cbmicro_008502,methyl 2-nitro-m-anisate,methyl 3-methoxy-2-nitro-benzoate,2-nitro-m-anisic acid methyl ester,3-methoxy-2-nitro-benzoic acid methyl ester CID PubChem: 79195 Nom IUPAC: methyl 3-methoxy-2-nitrobenzoate SMILES: COC(=O)C1=CC=CC(OC)=C1[N+]([O-])=O
Poids moléculaire (g/mol) | 211.17 |
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Synonyme | benzoic acid, 3-methoxy-2-nitro-, methyl ester,3-methoxy-2-nitrobenzoic acid methyl ester,m-anisic acid, 2-nitro-, methyl ester,maybridge1_002124,cbmicro_008502,methyl 2-nitro-m-anisate,methyl 3-methoxy-2-nitro-benzoate,2-nitro-m-anisic acid methyl ester,3-methoxy-2-nitro-benzoic acid methyl ester |
Numéro MDL | MFCD00051968 |
CAS | 5307-17-5 |
CID PubChem | 79195 |
Nom IUPAC | methyl 3-methoxy-2-nitrobenzoate |
Clé InChI | FDQQRLPHAAICCR-UHFFFAOYSA-N |
SMILES | COC(=O)C1=CC=CC(OC)=C1[N+]([O-])=O |
Formule moléculaire | C9H9NO5 |
Sodium 3-nitrobenzoate, 94%, may contain up to ca 10% water
CAS: 827-95-2 Formule moléculaire: C7H4NNaO4 Poids moléculaire (g/mol): 189.10 Numéro MDL: MFCD00150535,MFCD00051097 Clé InChI: MUADFEZFSKAZLT-UHFFFAOYSA-M Synonyme: sodium 3-nitrobenzoate,3-nitrobenzoic acid sodium salt,benzoic acid, 3-nitro-, sodium salt,unii-i1eq837b3j,m-nitrobenzoic acid sodium salt,sodium m-nitrobenzoate,benzoic acid, 3-nitro-, sodium salt 1:1,3-nitrobenzoic acid, sodium salt,acmc-209pqe,dsstox_cid_24733 CID PubChem: 70014 Nom IUPAC: sodium;3-nitrobenzoate SMILES: [Na+].[O-]C(=O)C1=CC=CC(=C1)[N+]([O-])=O
Poids moléculaire (g/mol) | 189.10 |
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Synonyme | sodium 3-nitrobenzoate,3-nitrobenzoic acid sodium salt,benzoic acid, 3-nitro-, sodium salt,unii-i1eq837b3j,m-nitrobenzoic acid sodium salt,sodium m-nitrobenzoate,benzoic acid, 3-nitro-, sodium salt 1:1,3-nitrobenzoic acid, sodium salt,acmc-209pqe,dsstox_cid_24733 |
Numéro MDL | MFCD00150535,MFCD00051097 |
CAS | 827-95-2 |
CID PubChem | 70014 |
Nom IUPAC | sodium;3-nitrobenzoate |
Clé InChI | MUADFEZFSKAZLT-UHFFFAOYSA-M |
SMILES | [Na+].[O-]C(=O)C1=CC=CC(=C1)[N+]([O-])=O |
Formule moléculaire | C7H4NNaO4 |
2-Methyl-5-nitrobenzoic acid, 98+%
CAS: 1975-52-6 Formule moléculaire: C8H7NO4 Poids moléculaire (g/mol): 181.147 Numéro MDL: MFCD00007371 Clé InChI: DJRFJAVPROZZFL-UHFFFAOYSA-N Synonyme: 2-methyl-5-nitrobenzoic acid,5-nitro-o-toluic acid,benzoic acid, 2-methyl-5-nitro,2-methyl-5-nitro-benzoic acid,5-nitro-2-methylbenzoic acid,rarechem al bo 0285,5-nitro-2-methyl benzoic acid,2-methyl-5-nitro benzoic acid,pubchem2244 CID PubChem: 519683 SMILES: CC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)O
Poids moléculaire (g/mol) | 181.147 |
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Synonyme | 2-methyl-5-nitrobenzoic acid,5-nitro-o-toluic acid,benzoic acid, 2-methyl-5-nitro,2-methyl-5-nitro-benzoic acid,5-nitro-2-methylbenzoic acid,rarechem al bo 0285,5-nitro-2-methyl benzoic acid,2-methyl-5-nitro benzoic acid,pubchem2244 |
Numéro MDL | MFCD00007371 |
CAS | 1975-52-6 |
CID PubChem | 519683 |
Clé InChI | DJRFJAVPROZZFL-UHFFFAOYSA-N |
SMILES | CC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)O |
Formule moléculaire | C8H7NO4 |
3-Hydroxy-2-nitrobenzoic acid, 98+%
CAS: 602-00-6 Formule moléculaire: C7H5NO5 Poids moléculaire (g/mol): 183.119 Numéro MDL: MFCD00017003 Clé InChI: KPDBKQKRDJPBRM-UHFFFAOYSA-N Synonyme: 3-hydroxy-2-nitrobenzoic acid,3-hydroxy-2-nitrobenzoicacid,3-hydroxy-2-nitro-benzoic acid,2-nitro-3-hydroxybenzoic acid,pubchem8846,nitro-m-oxybenzoesaure,benzoic acid, hydroxynitro,ksc288q8j,acmc-1b214,2-nitro-3-oxidanyl-benzoic acid CID PubChem: 293291 SMILES: C1=CC(=C(C(=C1)O)[N+](=O)[O-])C(=O)O
Poids moléculaire (g/mol) | 183.119 |
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Synonyme | 3-hydroxy-2-nitrobenzoic acid,3-hydroxy-2-nitrobenzoicacid,3-hydroxy-2-nitro-benzoic acid,2-nitro-3-hydroxybenzoic acid,pubchem8846,nitro-m-oxybenzoesaure,benzoic acid, hydroxynitro,ksc288q8j,acmc-1b214,2-nitro-3-oxidanyl-benzoic acid |
Numéro MDL | MFCD00017003 |
CAS | 602-00-6 |
CID PubChem | 293291 |
Clé InChI | KPDBKQKRDJPBRM-UHFFFAOYSA-N |
SMILES | C1=CC(=C(C(=C1)O)[N+](=O)[O-])C(=O)O |
Formule moléculaire | C7H5NO5 |
Ethyl 4-hydroxy-3-nitrobenzoate, 98%
CAS: 19013-10-6 Formule moléculaire: C9H9NO5 Poids moléculaire (g/mol): 211.173 Numéro MDL: MFCD00016999 Clé InChI: FBHJNBWUGONVNS-UHFFFAOYSA-N Synonyme: benzoic acid, 4-hydroxy-3-nitro-, ethyl ester,4-hydroxy-3-nitrobenzoic acid ethyl ester,acmc-20akyj,ethyl4-hydroxy-3-nitrobenzoate,ethyl 3-nitro-4-hydroxybenzoate,ethyl 4-hydroxy-3-nitro benzoate,3-nitro-4-hydroxybenzoic acid ethyl ester,4-hydroxy-3-nitro-benzoic acid ethyl ester CID PubChem: 87895 Nom IUPAC: ethyl 4-hydroxy-3-nitrobenzoate SMILES: CCOC(=O)C1=CC(=C(C=C1)O)[N+](=O)[O-]
Poids moléculaire (g/mol) | 211.173 |
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Synonyme | benzoic acid, 4-hydroxy-3-nitro-, ethyl ester,4-hydroxy-3-nitrobenzoic acid ethyl ester,acmc-20akyj,ethyl4-hydroxy-3-nitrobenzoate,ethyl 3-nitro-4-hydroxybenzoate,ethyl 4-hydroxy-3-nitro benzoate,3-nitro-4-hydroxybenzoic acid ethyl ester,4-hydroxy-3-nitro-benzoic acid ethyl ester |
Numéro MDL | MFCD00016999 |
CAS | 19013-10-6 |
CID PubChem | 87895 |
Nom IUPAC | ethyl 4-hydroxy-3-nitrobenzoate |
Clé InChI | FBHJNBWUGONVNS-UHFFFAOYSA-N |
SMILES | CCOC(=O)C1=CC(=C(C=C1)O)[N+](=O)[O-] |
Formule moléculaire | C9H9NO5 |
5-Methyl-2-nitrobenzoic acid, 98+%
CAS: 3113-72-2 Formule moléculaire: C8H7NO4 Poids moléculaire (g/mol): 181.147 Numéro MDL: MFCD00007368 Clé InChI: QRRSIFNWHCKMSW-UHFFFAOYSA-N Synonyme: 5-methyl-2-nitrobenzoic acid,2-nitro-5-methylbenzoic acid,benzoic acid, 5-methyl-2-nitro,3-methyl-6-nitrobenzoic acid,6-nitro-m-toluic acid,m-toluic acid, 6-nitro,6-nitro-p-toluic acid,5-methyl-2-nitrobenzoicacid,5-methyl-2-nitro-benzoic acid,benzoic acid,5-methyl-2-nitro CID PubChem: 18371 SMILES: CC1=CC(=C(C=C1)[N+](=O)[O-])C(=O)O
Poids moléculaire (g/mol) | 181.147 |
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Synonyme | 5-methyl-2-nitrobenzoic acid,2-nitro-5-methylbenzoic acid,benzoic acid, 5-methyl-2-nitro,3-methyl-6-nitrobenzoic acid,6-nitro-m-toluic acid,m-toluic acid, 6-nitro,6-nitro-p-toluic acid,5-methyl-2-nitrobenzoicacid,5-methyl-2-nitro-benzoic acid,benzoic acid,5-methyl-2-nitro |
Numéro MDL | MFCD00007368 |
CAS | 3113-72-2 |
CID PubChem | 18371 |
Clé InChI | QRRSIFNWHCKMSW-UHFFFAOYSA-N |
SMILES | CC1=CC(=C(C=C1)[N+](=O)[O-])C(=O)O |
Formule moléculaire | C8H7NO4 |
Methyl 2-nitro-3,4,5-trimethoxybenzoate, 98%
CAS: 5081-42-5 Formule moléculaire: C11H13NO7 Poids moléculaire (g/mol): 271.225 Numéro MDL: MFCD00007097 Clé InChI: HCEIEWYPDCDNNU-UHFFFAOYSA-N Synonyme: methyl 2-nitro-3,4,5-trimethoxybenzoate,methyl 6-nitro-3,4,5-trimethoxybenzoate,3,4,5-trimethoxy-2-nitrobenzoic acid methyl ester,benzoic acid, 3,4,5-trimethoxy-2-nitro-, methyl ester,2-nitro-3,4,5-trimethoxybenzoic acid methyl ester,pubchem22545,opera_id_1985,acmc-1ar8w,hceiewypdcdnnu-uhfffaoysa,methyl 3,5-trimethoxy-2-nitrobenzoate CID PubChem: 78765 Nom IUPAC: methyl 3,4,5-trimethoxy-2-nitrobenzoate SMILES: COC1=C(C(=C(C(=C1)C(=O)OC)[N+](=O)[O-])OC)OC
Poids moléculaire (g/mol) | 271.225 |
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Synonyme | methyl 2-nitro-3,4,5-trimethoxybenzoate,methyl 6-nitro-3,4,5-trimethoxybenzoate,3,4,5-trimethoxy-2-nitrobenzoic acid methyl ester,benzoic acid, 3,4,5-trimethoxy-2-nitro-, methyl ester,2-nitro-3,4,5-trimethoxybenzoic acid methyl ester,pubchem22545,opera_id_1985,acmc-1ar8w,hceiewypdcdnnu-uhfffaoysa,methyl 3,5-trimethoxy-2-nitrobenzoate |
Numéro MDL | MFCD00007097 |
CAS | 5081-42-5 |
CID PubChem | 78765 |
Nom IUPAC | methyl 3,4,5-trimethoxy-2-nitrobenzoate |
Clé InChI | HCEIEWYPDCDNNU-UHFFFAOYSA-N |
SMILES | COC1=C(C(=C(C(=C1)C(=O)OC)[N+](=O)[O-])OC)OC |
Formule moléculaire | C11H13NO7 |
Dimethyl 3-nitrophthalate, 98%
CAS: 13365-26-9 Formule moléculaire: C10H9NO6 Poids moléculaire (g/mol): 239.183 Numéro MDL: MFCD00017184 Clé InChI: MLQMIKSBTAZNBK-UHFFFAOYSA-N CID PubChem: 249912 Nom IUPAC: dimethyl 3-nitrobenzene-1,2-dicarboxylate SMILES: COC(=O)C1=C(C(=CC=C1)[N+](=O)[O-])C(=O)OC
Poids moléculaire (g/mol) | 239.183 |
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Numéro MDL | MFCD00017184 |
CAS | 13365-26-9 |
CID PubChem | 249912 |
Nom IUPAC | dimethyl 3-nitrobenzene-1,2-dicarboxylate |
Clé InChI | MLQMIKSBTAZNBK-UHFFFAOYSA-N |
SMILES | COC(=O)C1=C(C(=CC=C1)[N+](=O)[O-])C(=O)OC |
Formule moléculaire | C10H9NO6 |
2-Methyl-6-nitrobenzoic acid, 98%
CAS: 13506-76-8 Formule moléculaire: C8H7NO4 Poids moléculaire (g/mol): 181.147 Numéro MDL: MFCD00007267 Clé InChI: CCXSGQZMYLXTOI-UHFFFAOYSA-N Synonyme: 2-methyl-6-nitrobenzoic acid,6-nitro-o-toluic acid,benzoic acid, 2-methyl-6-nitro,6-methyl-2-nitrobenzoic acid,2-methyl-6-nitro-benzoic acid,o-toluic acid, 6-nitro,2-methyl-6-nitrobenzoicacid,unii-jm85y56dx1,nitrotoluylsaure,nitro-ortho-toluic acid CID PubChem: 16097 SMILES: CC1=C(C(=CC=C1)[N+](=O)[O-])C(=O)O
Poids moléculaire (g/mol) | 181.147 |
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Synonyme | 2-methyl-6-nitrobenzoic acid,6-nitro-o-toluic acid,benzoic acid, 2-methyl-6-nitro,6-methyl-2-nitrobenzoic acid,2-methyl-6-nitro-benzoic acid,o-toluic acid, 6-nitro,2-methyl-6-nitrobenzoicacid,unii-jm85y56dx1,nitrotoluylsaure,nitro-ortho-toluic acid |
Numéro MDL | MFCD00007267 |
CAS | 13506-76-8 |
CID PubChem | 16097 |
Clé InChI | CCXSGQZMYLXTOI-UHFFFAOYSA-N |
SMILES | CC1=C(C(=CC=C1)[N+](=O)[O-])C(=O)O |
Formule moléculaire | C8H7NO4 |
Methyl 4-chloro-3-nitrobenzoate, 98%
CAS: 14719-83-6 Formule moléculaire: C8H6ClNO4 Poids moléculaire (g/mol): 215.59 Numéro MDL: MFCD00016989 Clé InChI: XRTKWPWDSUNLHS-UHFFFAOYSA-N Synonyme: methyl 4-chloro-3-nitrobenzate,4-chloro-3-nitrobenzoic acid methyl ester,methyl-4-chloro-3-nitrobenzoate,benzoic acid, 4-chloro-3-nitro-, methyl ester,acmc-209cya,methyl-3-nitro-4-chlorobenzoate,methyl 3-nitro-4-chlorobenzoate,xrtkwpwdsunlhs-uhfffaoysa,methyl 4-chloro-3-nitro-benzoate,methyl4-chloro-3-nitrobenzoate CID PubChem: 735797 Nom IUPAC: methyl 4-chloro-3-nitrobenzoate SMILES: COC(=O)C1=CC=C(Cl)C(=C1)[N+]([O-])=O
Poids moléculaire (g/mol) | 215.59 |
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Synonyme | methyl 4-chloro-3-nitrobenzate,4-chloro-3-nitrobenzoic acid methyl ester,methyl-4-chloro-3-nitrobenzoate,benzoic acid, 4-chloro-3-nitro-, methyl ester,acmc-209cya,methyl-3-nitro-4-chlorobenzoate,methyl 3-nitro-4-chlorobenzoate,xrtkwpwdsunlhs-uhfffaoysa,methyl 4-chloro-3-nitro-benzoate,methyl4-chloro-3-nitrobenzoate |
Numéro MDL | MFCD00016989 |
CAS | 14719-83-6 |
CID PubChem | 735797 |
Nom IUPAC | methyl 4-chloro-3-nitrobenzoate |
Clé InChI | XRTKWPWDSUNLHS-UHFFFAOYSA-N |
SMILES | COC(=O)C1=CC=C(Cl)C(=C1)[N+]([O-])=O |
Formule moléculaire | C8H6ClNO4 |