Benzene and substituted derivatives
Filtered Search Results
2-Chloro-5-nitrobenzoic Acid, 99+%
CAS: 2516-96-3 Molecular Formula: C7H4ClNO4 Molecular Weight (g/mol): 201.56 MDL Number: MFCD00007294 InChI Key: QUEKGYQTRJVEQC-UHFFFAOYSA-N Synonym: 2-chloro-5-nitrobenzoic acid,benzoic acid, 2-chloro-5-nitro,6-chloro-3-nitrobenzoic acid,2-chloro-5-nitro-benzoic acid,2-chloro-5-nitrobenzoicacid,mesalamine impurity m,pubchem13682,acmc-1cb0i,2-chloro-5-nitrobenzic acid,5-nitro-2-chlorobenzoic acid PubChem CID: 17287 SMILES: C1=CC(=C(C=C1[N+](=O)[O-])C(=O)O)Cl
| PubChem CID | 17287 |
|---|---|
| CAS | 2516-96-3 |
| Molecular Weight (g/mol) | 201.56 |
| MDL Number | MFCD00007294 |
| SMILES | C1=CC(=C(C=C1[N+](=O)[O-])C(=O)O)Cl |
| Synonym | 2-chloro-5-nitrobenzoic acid,benzoic acid, 2-chloro-5-nitro,6-chloro-3-nitrobenzoic acid,2-chloro-5-nitro-benzoic acid,2-chloro-5-nitrobenzoicacid,mesalamine impurity m,pubchem13682,acmc-1cb0i,2-chloro-5-nitrobenzic acid,5-nitro-2-chlorobenzoic acid |
| InChI Key | QUEKGYQTRJVEQC-UHFFFAOYSA-N |
| Molecular Formula | C7H4ClNO4 |
2-Methyl-5-nitrobenzoic acid, 99+%, Thermo Scientific™
CAS: 1975-52-6 Molecular Formula: C8H7NO4 Molecular Weight (g/mol): 181.15 MDL Number: MFCD00007371 InChI Key: DJRFJAVPROZZFL-UHFFFAOYSA-N Synonym: 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 PubChem CID: 519683 SMILES: CC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)O
| PubChem CID | 519683 |
|---|---|
| CAS | 1975-52-6 |
| Molecular Weight (g/mol) | 181.15 |
| MDL Number | MFCD00007371 |
| SMILES | CC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)O |
| Synonym | 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 |
| InChI Key | DJRFJAVPROZZFL-UHFFFAOYSA-N |
| Molecular Formula | C8H7NO4 |
5-Methoxy-2-nitrobenzoic acid, 97%
CAS: 1882-69-5 Molecular Formula: C8H6NO5 Molecular Weight (g/mol): 196.14 MDL Number: MFCD00151836 InChI Key: URADKXVAIGMTEG-UHFFFAOYSA-M Synonym: 5-methoxy-2-nitrobenzoic acid,2-nitro-5-methoxybenzoic acid,6-nitro-m-anisic acid,5-methoxy-2-nitro-benzoic acid,benzoic acid, 5-methoxy-2-nitro,pubchem4229,acmc-1brd6,2-nitro-5-methoxybenzoate,2-nitro-5-methoxybenzoicacid,5-methoxy-2-nitrobenzoicacid PubChem CID: 339209 IUPAC Name: 5-methoxy-2-nitrobenzoate SMILES: COC1=CC=C(C(=C1)C([O-])=O)[N+]([O-])=O
| PubChem CID | 339209 |
|---|---|
| CAS | 1882-69-5 |
| Molecular Weight (g/mol) | 196.14 |
| MDL Number | MFCD00151836 |
| SMILES | COC1=CC=C(C(=C1)C([O-])=O)[N+]([O-])=O |
| Synonym | 5-methoxy-2-nitrobenzoic acid,2-nitro-5-methoxybenzoic acid,6-nitro-m-anisic acid,5-methoxy-2-nitro-benzoic acid,benzoic acid, 5-methoxy-2-nitro,pubchem4229,acmc-1brd6,2-nitro-5-methoxybenzoate,2-nitro-5-methoxybenzoicacid,5-methoxy-2-nitrobenzoicacid |
| IUPAC Name | 5-methoxy-2-nitrobenzoate |
| InChI Key | URADKXVAIGMTEG-UHFFFAOYSA-M |
| Molecular Formula | C8H6NO5 |
3-Hydroxy-4-nitrobenzoic acid, 98%
CAS: 619-14-7 Molecular Formula: C7H5NO5 Molecular Weight (g/mol): 183.12 MDL Number: MFCD00007110 InChI Key: XLDLRRGZWIEEHT-UHFFFAOYSA-N Synonym: 3-hydroxy-4-nitrobenzoic acid,3-hydroxy-4-nitro-benzoic acid,4-nitro-3-hydroxybenzoic acid,benzoic acid, 3-hydroxy-4-nitro,3-hydroxy-4-nitrobenzoicacid,pubchem17135,acmc-209mxi,3-hydroxy4nitrobenzoic acid,ksc356q8j,3-hydroxy-4-nitro benzoic acid PubChem CID: 69265 IUPAC Name: 3-hydroxy-4-nitrobenzoic acid SMILES: OC(=O)C1=CC=C(C(O)=C1)[N+]([O-])=O
| PubChem CID | 69265 |
|---|---|
| CAS | 619-14-7 |
| Molecular Weight (g/mol) | 183.12 |
| MDL Number | MFCD00007110 |
| SMILES | OC(=O)C1=CC=C(C(O)=C1)[N+]([O-])=O |
| Synonym | 3-hydroxy-4-nitrobenzoic acid,3-hydroxy-4-nitro-benzoic acid,4-nitro-3-hydroxybenzoic acid,benzoic acid, 3-hydroxy-4-nitro,3-hydroxy-4-nitrobenzoicacid,pubchem17135,acmc-209mxi,3-hydroxy4nitrobenzoic acid,ksc356q8j,3-hydroxy-4-nitro benzoic acid |
| IUPAC Name | 3-hydroxy-4-nitrobenzoic acid |
| InChI Key | XLDLRRGZWIEEHT-UHFFFAOYSA-N |
| Molecular Formula | C7H5NO5 |
2-Methyl-6-nitrobenzoic acid, 98%
CAS: 13506-76-8 Molecular Formula: C8H7NO4 Molecular Weight (g/mol): 181.147 MDL Number: MFCD00007267 InChI Key: CCXSGQZMYLXTOI-UHFFFAOYSA-N Synonym: 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 PubChem CID: 16097 SMILES: CC1=C(C(=CC=C1)[N+](=O)[O-])C(=O)O
| PubChem CID | 16097 |
|---|---|
| CAS | 13506-76-8 |
| Molecular Weight (g/mol) | 181.147 |
| MDL Number | MFCD00007267 |
| SMILES | CC1=C(C(=CC=C1)[N+](=O)[O-])C(=O)O |
| Synonym | 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 |
| InChI Key | CCXSGQZMYLXTOI-UHFFFAOYSA-N |
| Molecular Formula | C8H7NO4 |
Methyl 3-nitrosalicylate, 98%, Thermo Scientific Chemicals
CAS: 22621-41-6 Molecular Formula: C8H7NO5 Molecular Weight (g/mol): 197.15 MDL Number: MFCD00272263 InChI Key: NIBVYEHAFBEVFI-UHFFFAOYSA-N Synonym: methyl 2-hydroxy-3-nitrobenzoate,methyl 3-nitrosalicylate,benzoic acid, 2-hydroxy-3-nitro-, methyl ester,2-hydroxy-3-nitrobenzoic acid methyl ester,2-hydroxy-3-nitro-benzoic acid methyl ester,salicylic acid, 3-nitro-, methyl ester,methyl-3-nitrosalicylat,methyl-m-nitrosalicylate,acmc-209fxo,ksc490c4l PubChem CID: 596904 SMILES: COC(=O)C1=C(C(=CC=C1)[N+](=O)[O-])O
| PubChem CID | 596904 |
|---|---|
| CAS | 22621-41-6 |
| Molecular Weight (g/mol) | 197.15 |
| MDL Number | MFCD00272263 |
| SMILES | COC(=O)C1=C(C(=CC=C1)[N+](=O)[O-])O |
| Synonym | methyl 2-hydroxy-3-nitrobenzoate,methyl 3-nitrosalicylate,benzoic acid, 2-hydroxy-3-nitro-, methyl ester,2-hydroxy-3-nitrobenzoic acid methyl ester,2-hydroxy-3-nitro-benzoic acid methyl ester,salicylic acid, 3-nitro-, methyl ester,methyl-3-nitrosalicylat,methyl-m-nitrosalicylate,acmc-209fxo,ksc490c4l |
| InChI Key | NIBVYEHAFBEVFI-UHFFFAOYSA-N |
| Molecular Formula | C8H7NO5 |
3-Chloro-2-nitrobenzoic acid, 97%
CAS: 4771-47-5 Molecular Formula: C7H4ClNO4 Molecular Weight (g/mol): 201.562 MDL Number: MFCD00007087 InChI Key: VCHSXYHBMFKRBK-UHFFFAOYSA-N Synonym: 3-chloro-2-nitrobenzoic acid,benzoic acid, 3-chloro-2-nitro,3-chloro-2-nitrobenzoicacid,3-chloro-2-nitro-benzoic acid,chlornitrobenzoesaure,pubchem11043,chloro-2-nitrobenzoic acid,acmc-209ka6,3-chloro2-nitrobenzoic acid,ksc237s1n PubChem CID: 20902 SMILES: C1=CC(=C(C(=C1)Cl)[N+](=O)[O-])C(=O)O
| PubChem CID | 20902 |
|---|---|
| CAS | 4771-47-5 |
| Molecular Weight (g/mol) | 201.562 |
| MDL Number | MFCD00007087 |
| SMILES | C1=CC(=C(C(=C1)Cl)[N+](=O)[O-])C(=O)O |
| Synonym | 3-chloro-2-nitrobenzoic acid,benzoic acid, 3-chloro-2-nitro,3-chloro-2-nitrobenzoicacid,3-chloro-2-nitro-benzoic acid,chlornitrobenzoesaure,pubchem11043,chloro-2-nitrobenzoic acid,acmc-209ka6,3-chloro2-nitrobenzoic acid,ksc237s1n |
| InChI Key | VCHSXYHBMFKRBK-UHFFFAOYSA-N |
| Molecular Formula | C7H4ClNO4 |
Ethyl 2-nitrobenzoate, 97%
CAS: 610-34-4 Molecular Formula: C9H9NO4 Molecular Weight (g/mol): 195.17 MDL Number: MFCD00014696 InChI Key: CPNMAYYYYSWTIV-UHFFFAOYSA-N Synonym: ethyl o-nitrobenzoate,ethyl nitrobenzoate,benzoic acid, o-nitro-, ethyl ester,benzoic acid, 2-nitro-, ethyl ester,nitrobenzoesaureathylester,acmc-1aul6,2-nitro-benzoic acid ethyl ester PubChem CID: 69123 IUPAC Name: ethyl 2-nitrobenzoate SMILES: CCOC(=O)C1=CC=CC=C1[N+]([O-])=O
| PubChem CID | 69123 |
|---|---|
| CAS | 610-34-4 |
| Molecular Weight (g/mol) | 195.17 |
| MDL Number | MFCD00014696 |
| SMILES | CCOC(=O)C1=CC=CC=C1[N+]([O-])=O |
| Synonym | ethyl o-nitrobenzoate,ethyl nitrobenzoate,benzoic acid, o-nitro-, ethyl ester,benzoic acid, 2-nitro-, ethyl ester,nitrobenzoesaureathylester,acmc-1aul6,2-nitro-benzoic acid ethyl ester |
| IUPAC Name | ethyl 2-nitrobenzoate |
| InChI Key | CPNMAYYYYSWTIV-UHFFFAOYSA-N |
| Molecular Formula | C9H9NO4 |
4-Bromo-2-fluorotoluene, 99%
CAS: 51436-99-8 Molecular Formula: C7H6BrF Molecular Weight (g/mol): 189.027 MDL Number: MFCD00013551 InChI Key: YZFVUQSAJMLFOZ-UHFFFAOYSA-N Synonym: 4-bromo-2-fluorotoluene,2-fluoro-4-bromotoluene,benzene, 4-bromo-2-fluoro-1-methyl,toluene,2-fluoro-4-bromo,4-bromo-2-fluoro-1-methyl-benzene,pubchem1601,acmc-1an2v,2-fluoro-4-bromo toluene,4-bromo-2-fluoro-toluene PubChem CID: 171040 IUPAC Name: 4-bromo-2-fluoro-1-methylbenzene SMILES: CC1=C(C=C(C=C1)Br)F
| PubChem CID | 171040 |
|---|---|
| CAS | 51436-99-8 |
| Molecular Weight (g/mol) | 189.027 |
| MDL Number | MFCD00013551 |
| SMILES | CC1=C(C=C(C=C1)Br)F |
| Synonym | 4-bromo-2-fluorotoluene,2-fluoro-4-bromotoluene,benzene, 4-bromo-2-fluoro-1-methyl,toluene,2-fluoro-4-bromo,4-bromo-2-fluoro-1-methyl-benzene,pubchem1601,acmc-1an2v,2-fluoro-4-bromo toluene,4-bromo-2-fluoro-toluene |
| IUPAC Name | 4-bromo-2-fluoro-1-methylbenzene |
| InChI Key | YZFVUQSAJMLFOZ-UHFFFAOYSA-N |
| Molecular Formula | C7H6BrF |
Hexafluorobenzene, 99%
CAS: 392-56-3 Molecular Formula: C6F6 Molecular Weight (g/mol): 186.06 MDL Number: MFCD00000288 InChI Key: ZQBFAOFFOQMSGJ-UHFFFAOYSA-N Synonym: hexafluorobenzene,perfluorobenzene,benzene, hexafluoro,hexafluorbenzol,unii-cmc18t611k,benzene, 1,2,3,4,5,6-hexafluoro,hexa fluorobenzene,hexafluoro benzene,pubchem18879,acmc-1bmus PubChem CID: 9805 ChEBI: CHEBI:38589 IUPAC Name: 1,2,3,4,5,6-hexafluorobenzene SMILES: C1(=C(C(=C(C(=C1F)F)F)F)F)F
| PubChem CID | 9805 |
|---|---|
| CAS | 392-56-3 |
| Molecular Weight (g/mol) | 186.06 |
| ChEBI | CHEBI:38589 |
| MDL Number | MFCD00000288 |
| SMILES | C1(=C(C(=C(C(=C1F)F)F)F)F)F |
| Synonym | hexafluorobenzene,perfluorobenzene,benzene, hexafluoro,hexafluorbenzol,unii-cmc18t611k,benzene, 1,2,3,4,5,6-hexafluoro,hexa fluorobenzene,hexafluoro benzene,pubchem18879,acmc-1bmus |
| IUPAC Name | 1,2,3,4,5,6-hexafluorobenzene |
| InChI Key | ZQBFAOFFOQMSGJ-UHFFFAOYSA-N |
| Molecular Formula | C6F6 |
2-Bromo-4,6-dichloroaniline, 98%, Thermo Scientific™
CAS: 697-86-9 Molecular Formula: C6H4BrCl2N Molecular Weight (g/mol): 240.91 MDL Number: MFCD00040936 InChI Key: DTPADCOGQUOGHT-UHFFFAOYSA-N Synonym: pubchem3605,acmc-209ob3,6-bromo-2,4-dichloroaniline,2,4-dichloro-6-bromoaniline,2-bromo-4,6-dichloro-aniline,6-bromo-2,4-dichlorophenylamine,benzenamine,2-bromo-4,6-dichloro,2-bromo-4,6-dichloroaniline,2-bromanyl-4,6-bis chloranyl aniline PubChem CID: 2756901 IUPAC Name: 2-bromo-4,6-dichloroaniline SMILES: C1=C(C=C(C(=C1Cl)N)Br)Cl
| PubChem CID | 2756901 |
|---|---|
| CAS | 697-86-9 |
| Molecular Weight (g/mol) | 240.91 |
| MDL Number | MFCD00040936 |
| SMILES | C1=C(C=C(C(=C1Cl)N)Br)Cl |
| Synonym | pubchem3605,acmc-209ob3,6-bromo-2,4-dichloroaniline,2,4-dichloro-6-bromoaniline,2-bromo-4,6-dichloro-aniline,6-bromo-2,4-dichlorophenylamine,benzenamine,2-bromo-4,6-dichloro,2-bromo-4,6-dichloroaniline,2-bromanyl-4,6-bis chloranyl aniline |
| IUPAC Name | 2-bromo-4,6-dichloroaniline |
| InChI Key | DTPADCOGQUOGHT-UHFFFAOYSA-N |
| Molecular Formula | C6H4BrCl2N |
Potassium 2,4-difluorophenyltrifluoroborate, 95%
CAS: 871231-41-3 Molecular Formula: C6H3BF5K Molecular Weight (g/mol): 219.99 MDL Number: MFCD07784375 InChI Key: HZKKNPYRMYVEOW-UHFFFAOYSA-N Synonym: potassium 2,4-difluorophenyltrifluoroborate,potassium 2,4-difluorophenyl trifluoroborate,potassium 2,4-difluorophenyl trifluoroboranuide,pubchem11329,potassium 2,4-difluorophenyl trifluoro borate 1- PubChem CID: 23697340 IUPAC Name: potassium;(2,4-difluorophenyl)-trifluoroboranuide SMILES: [B-](C1=C(C=C(C=C1)F)F)(F)(F)F.[K+]
| PubChem CID | 23697340 |
|---|---|
| CAS | 871231-41-3 |
| Molecular Weight (g/mol) | 219.99 |
| MDL Number | MFCD07784375 |
| SMILES | [B-](C1=C(C=C(C=C1)F)F)(F)(F)F.[K+] |
| Synonym | potassium 2,4-difluorophenyltrifluoroborate,potassium 2,4-difluorophenyl trifluoroborate,potassium 2,4-difluorophenyl trifluoroboranuide,pubchem11329,potassium 2,4-difluorophenyl trifluoro borate 1- |
| IUPAC Name | potassium;(2,4-difluorophenyl)-trifluoroboranuide |
| InChI Key | HZKKNPYRMYVEOW-UHFFFAOYSA-N |
| Molecular Formula | C6H3BF5K |
2,6-Dinitroaniline, 98%
CAS: 606-22-4 Molecular Formula: C6H5N3O4 Molecular Weight (g/mol): 183.123 MDL Number: MFCD00007148 InChI Key: QFUSCYRJMXLNRB-UHFFFAOYSA-N Synonym: benzenamine, 2,6-dinitro,2,6-dinitrobenzenamine,aniline, 2,6-dinitro,unii-8w27g0qbd7,ccris 3108,pubchem22911,wln: wnr bz cnw,acmc-209ml1,2,6-dinitroaniline,2,6-dinitro-phenyl-amine PubChem CID: 69070 IUPAC Name: 2,6-dinitroaniline SMILES: C1=CC(=C(C(=C1)[N+](=O)[O-])N)[N+](=O)[O-]
| PubChem CID | 69070 |
|---|---|
| CAS | 606-22-4 |
| Molecular Weight (g/mol) | 183.123 |
| MDL Number | MFCD00007148 |
| SMILES | C1=CC(=C(C(=C1)[N+](=O)[O-])N)[N+](=O)[O-] |
| Synonym | benzenamine, 2,6-dinitro,2,6-dinitrobenzenamine,aniline, 2,6-dinitro,unii-8w27g0qbd7,ccris 3108,pubchem22911,wln: wnr bz cnw,acmc-209ml1,2,6-dinitroaniline,2,6-dinitro-phenyl-amine |
| IUPAC Name | 2,6-dinitroaniline |
| InChI Key | QFUSCYRJMXLNRB-UHFFFAOYSA-N |
| Molecular Formula | C6H5N3O4 |
4-Bromo-5-fluoro-2-methoxyaniline, 96%, Thermo Scientific Chemicals
CAS: 330794-03-1 Molecular Formula: C7H7BrFNO Molecular Weight (g/mol): 220.04 MDL Number: MFCD21603958 InChI Key: WOFOKKKWMDHLEX-UHFFFAOYSA-N Synonym: benzenamine, 4-bromo-5-fluoro-2-methoxy PubChem CID: 22347298 IUPAC Name: 4-bromo-5-fluoro-2-methoxyaniline SMILES: COC1=CC(Br)=C(F)C=C1N
| PubChem CID | 22347298 |
|---|---|
| CAS | 330794-03-1 |
| Molecular Weight (g/mol) | 220.04 |
| MDL Number | MFCD21603958 |
| SMILES | COC1=CC(Br)=C(F)C=C1N |
| Synonym | benzenamine, 4-bromo-5-fluoro-2-methoxy |
| IUPAC Name | 4-bromo-5-fluoro-2-methoxyaniline |
| InChI Key | WOFOKKKWMDHLEX-UHFFFAOYSA-N |
| Molecular Formula | C7H7BrFNO |
Tetrafluoroterephthalonitrile, 98%
CAS: 1835-49-0 Molecular Formula: C8F4N2 Molecular Weight (g/mol): 200.096 MDL Number: MFCD00001776 InChI Key: PCRSJGWFEMHHEW-UHFFFAOYSA-N Synonym: tetrafluoroterephthalonitrile,2,3,5,6-tetrafluoroterephthalonitrile,diamond 2031,2,3,5,6-tetrafluoro-1,4-benzenedicarbonitrile,1,4-benzenedicarbonitrile, 2,3,5,6-tetrafluoro,1,4-dicyanotetrafluorobenzene,terephthalonitrile, tetrafluoro,perfluoroterephthalonitrile,tetrafluoroterephthalodinitrile,tetrafluorobenzene-1,4-dicarbonitrile PubChem CID: 15783 IUPAC Name: 2,3,5,6-tetrafluorobenzene-1,4-dicarbonitrile SMILES: C(#N)C1=C(C(=C(C(=C1F)F)C#N)F)F
| PubChem CID | 15783 |
|---|---|
| CAS | 1835-49-0 |
| Molecular Weight (g/mol) | 200.096 |
| MDL Number | MFCD00001776 |
| SMILES | C(#N)C1=C(C(=C(C(=C1F)F)C#N)F)F |
| Synonym | tetrafluoroterephthalonitrile,2,3,5,6-tetrafluoroterephthalonitrile,diamond 2031,2,3,5,6-tetrafluoro-1,4-benzenedicarbonitrile,1,4-benzenedicarbonitrile, 2,3,5,6-tetrafluoro,1,4-dicyanotetrafluorobenzene,terephthalonitrile, tetrafluoro,perfluoroterephthalonitrile,tetrafluoroterephthalodinitrile,tetrafluorobenzene-1,4-dicarbonitrile |
| IUPAC Name | 2,3,5,6-tetrafluorobenzene-1,4-dicarbonitrile |
| InChI Key | PCRSJGWFEMHHEW-UHFFFAOYSA-N |
| Molecular Formula | C8F4N2 |