Benzene and substituted derivatives
Filtered Search Results
m-Toluic Acid 98.0+%, TCI America™
CAS: 99-04-7 Molecular Formula: C8H8O2 Molecular Weight (g/mol): 136.15 MDL Number: MFCD00002523 InChI Key: GPSDUZXPYCFOSQ-UHFFFAOYSA-N Synonym: m-toluic acid,m-toluylic acid,3-toluic acid,benzoic acid, 3-methyl,meta-toluic acid,m-methylbenzoic acid,beta-methylbenzoic acid,3-methyl-benzoic acid,beta-bethylbenzoic acid,unii-1ua7k8eext PubChem CID: 7418 ChEBI: CHEBI:10589 IUPAC Name: 3-methylbenzoic acid SMILES: CC1=CC=CC(=C1)C(O)=O
| PubChem CID | 7418 |
|---|---|
| CAS | 99-04-7 |
| Molecular Weight (g/mol) | 136.15 |
| ChEBI | CHEBI:10589 |
| MDL Number | MFCD00002523 |
| SMILES | CC1=CC=CC(=C1)C(O)=O |
| Synonym | m-toluic acid,m-toluylic acid,3-toluic acid,benzoic acid, 3-methyl,meta-toluic acid,m-methylbenzoic acid,beta-methylbenzoic acid,3-methyl-benzoic acid,beta-bethylbenzoic acid,unii-1ua7k8eext |
| IUPAC Name | 3-methylbenzoic acid |
| InChI Key | GPSDUZXPYCFOSQ-UHFFFAOYSA-N |
| Molecular Formula | C8H8O2 |
2,4,6-Trifluorobenzaldehyde 98.0+%, TCI America™
CAS: 58551-83-0 Molecular Formula: C7H3F3O Molecular Weight (g/mol): 160.095 MDL Number: MFCD00061197 InChI Key: KPJIEPBITZLHPQ-UHFFFAOYSA-N Synonym: benzaldehyde, 2,4,6-trifluoro,2,4,6-ttrifluorobenzaldehyde,pubchem1416,acmc-209m5d,2,4,6 trifluorobenzaldehyde,ksc272c8l,2,4,6-trifluoro benzaldehyde,2,4,6-trifluoro-benzaldehyde PubChem CID: 521845 IUPAC Name: 2,4,6-trifluorobenzaldehyde SMILES: C1=C(C=C(C(=C1F)C=O)F)F
| PubChem CID | 521845 |
|---|---|
| CAS | 58551-83-0 |
| Molecular Weight (g/mol) | 160.095 |
| MDL Number | MFCD00061197 |
| SMILES | C1=C(C=C(C(=C1F)C=O)F)F |
| Synonym | benzaldehyde, 2,4,6-trifluoro,2,4,6-ttrifluorobenzaldehyde,pubchem1416,acmc-209m5d,2,4,6 trifluorobenzaldehyde,ksc272c8l,2,4,6-trifluoro benzaldehyde,2,4,6-trifluoro-benzaldehyde |
| IUPAC Name | 2,4,6-trifluorobenzaldehyde |
| InChI Key | KPJIEPBITZLHPQ-UHFFFAOYSA-N |
| Molecular Formula | C7H3F3O |
Neopentyl Glycol Dibenzoate 98.0+%, TCI America™
CAS: 4196-89-8 Molecular Formula: C19H20O4 Molecular Weight (g/mol): 312.365 MDL Number: MFCD00020674 InChI Key: DYJIIMFHSZKBDY-UHFFFAOYSA-N Synonym: neopentyl glycol dibenzoate,2,2-dimethylpropane-1,3-diyl dibenzoate,unii-jbp9mr90cq,2,2-dimethyl-1,3-propanediol dibenzoate,1,3-propanediol, 2,2-dimethyl-, dibenzoate,jbp9mr90cq,3-benzoyloxy-2,2-dimethylpropyl benzoate,1,3-propanediol, 2,2-dimethyl-, 1,3-dibenzoate,neopentylglycoldibenzoate,2,3-propanediol dibenzoate PubChem CID: 20169 IUPAC Name: (3-benzoyloxy-2,2-dimethylpropyl) benzoate SMILES: CC(C)(COC(=O)C1=CC=CC=C1)COC(=O)C2=CC=CC=C2
| PubChem CID | 20169 |
|---|---|
| CAS | 4196-89-8 |
| Molecular Weight (g/mol) | 312.365 |
| MDL Number | MFCD00020674 |
| SMILES | CC(C)(COC(=O)C1=CC=CC=C1)COC(=O)C2=CC=CC=C2 |
| Synonym | neopentyl glycol dibenzoate,2,2-dimethylpropane-1,3-diyl dibenzoate,unii-jbp9mr90cq,2,2-dimethyl-1,3-propanediol dibenzoate,1,3-propanediol, 2,2-dimethyl-, dibenzoate,jbp9mr90cq,3-benzoyloxy-2,2-dimethylpropyl benzoate,1,3-propanediol, 2,2-dimethyl-, 1,3-dibenzoate,neopentylglycoldibenzoate,2,3-propanediol dibenzoate |
| IUPAC Name | (3-benzoyloxy-2,2-dimethylpropyl) benzoate |
| InChI Key | DYJIIMFHSZKBDY-UHFFFAOYSA-N |
| Molecular Formula | C19H20O4 |
Ethyl p-Toluate 99.0+%, TCI America™
CAS: 94-08-6 Molecular Formula: C10H12O2 Molecular Weight (g/mol): 164.204 MDL Number: MFCD00009117 InChI Key: NWPWRAWAUYIELB-UHFFFAOYSA-N Synonym: ethyl p-toluate,ethyl p-methylbenzoate,benzoic acid, 4-methyl-, ethyl ester,4-methylbenzoic acid ethyl ester,unii-xuf0sq8l2j,p-toluic acid ethyl ester,xuf0sq8l2j,p-toluic acid, ethyl ester,4-methyl-benzoic acid ethyl ester,ethyl4-methylbenzoate PubChem CID: 66743 IUPAC Name: ethyl 4-methylbenzoate SMILES: CCOC(=O)C1=CC=C(C=C1)C
| PubChem CID | 66743 |
|---|---|
| CAS | 94-08-6 |
| Molecular Weight (g/mol) | 164.204 |
| MDL Number | MFCD00009117 |
| SMILES | CCOC(=O)C1=CC=C(C=C1)C |
| Synonym | ethyl p-toluate,ethyl p-methylbenzoate,benzoic acid, 4-methyl-, ethyl ester,4-methylbenzoic acid ethyl ester,unii-xuf0sq8l2j,p-toluic acid ethyl ester,xuf0sq8l2j,p-toluic acid, ethyl ester,4-methyl-benzoic acid ethyl ester,ethyl4-methylbenzoate |
| IUPAC Name | ethyl 4-methylbenzoate |
| InChI Key | NWPWRAWAUYIELB-UHFFFAOYSA-N |
| Molecular Formula | C10H12O2 |
o-Tolualdehyde 98.0+%, TCI America™
CAS: 529-20-4 Molecular Formula: C8H8O Molecular Weight (g/mol): 120.151 MDL Number: MFCD00003338 InChI Key: BTFQKIATRPGRBS-UHFFFAOYSA-N Synonym: o-tolualdehyde,2-tolualdehyde,2-formyltoluene,o-toluylaldehyde,o-toluic aldehyde,o-tolylaldehyde,o-methylbenzaldehyde,benzaldehyde, 2-methyl,2-methyl-benzaldehyde,o-methylbenazldehyde PubChem CID: 10722 ChEBI: CHEBI:27434 IUPAC Name: 2-methylbenzaldehyde SMILES: CC1=CC=CC=C1C=O
| PubChem CID | 10722 |
|---|---|
| CAS | 529-20-4 |
| Molecular Weight (g/mol) | 120.151 |
| ChEBI | CHEBI:27434 |
| MDL Number | MFCD00003338 |
| SMILES | CC1=CC=CC=C1C=O |
| Synonym | o-tolualdehyde,2-tolualdehyde,2-formyltoluene,o-toluylaldehyde,o-toluic aldehyde,o-tolylaldehyde,o-methylbenzaldehyde,benzaldehyde, 2-methyl,2-methyl-benzaldehyde,o-methylbenazldehyde |
| IUPAC Name | 2-methylbenzaldehyde |
| InChI Key | BTFQKIATRPGRBS-UHFFFAOYSA-N |
| Molecular Formula | C8H8O |
Biphenyl-2-carboxylic Acid 98.0+%, TCI America™
CAS: 947-84-2 Molecular Formula: C13H10O2 Molecular Weight (g/mol): 198.221 MDL Number: MFCD00002463 InChI Key: ILYSAKHOYBPSPC-UHFFFAOYSA-N Synonym: 2-biphenylcarboxylic acid,1,1'-biphenyl-2-carboxylic acid,o-phenylbenzoic acid,biphenyl-2-carboxylic acid,biphenylcarboxylic acid,1,1'-biphenyl carboxylic acid,diphenyl-2-carboxylic acid,phenylbenzoic acid PubChem CID: 70357 IUPAC Name: 2-phenylbenzoic acid SMILES: C1=CC=C(C=C1)C2=CC=CC=C2C(=O)O
| PubChem CID | 70357 |
|---|---|
| CAS | 947-84-2 |
| Molecular Weight (g/mol) | 198.221 |
| MDL Number | MFCD00002463 |
| SMILES | C1=CC=C(C=C1)C2=CC=CC=C2C(=O)O |
| Synonym | 2-biphenylcarboxylic acid,1,1'-biphenyl-2-carboxylic acid,o-phenylbenzoic acid,biphenyl-2-carboxylic acid,biphenylcarboxylic acid,1,1'-biphenyl carboxylic acid,diphenyl-2-carboxylic acid,phenylbenzoic acid |
| IUPAC Name | 2-phenylbenzoic acid |
| InChI Key | ILYSAKHOYBPSPC-UHFFFAOYSA-N |
| Molecular Formula | C13H10O2 |
p-Tolualdehyde 95.0+%, TCI America™
CAS: 104-87-0 Molecular Formula: C8H8O Molecular Weight (g/mol): 120.151 MDL Number: MFCD00006954 InChI Key: FXLOVSHXALFLKQ-UHFFFAOYSA-N Synonym: p-tolualdehyde,4-tolualdehyde,p-formyltoluene,p-tolylaldehyde,p-toluylaldehyde,p-methylbenzaldehyde,para-tolualdehyde,benzaldehyde, 4-methyl,para-methylbenzaldehyde,para-toluyl aldehyde PubChem CID: 7725 ChEBI: CHEBI:28617 IUPAC Name: 4-methylbenzaldehyde SMILES: CC1=CC=C(C=C1)C=O
| PubChem CID | 7725 |
|---|---|
| CAS | 104-87-0 |
| Molecular Weight (g/mol) | 120.151 |
| ChEBI | CHEBI:28617 |
| MDL Number | MFCD00006954 |
| SMILES | CC1=CC=C(C=C1)C=O |
| Synonym | p-tolualdehyde,4-tolualdehyde,p-formyltoluene,p-tolylaldehyde,p-toluylaldehyde,p-methylbenzaldehyde,para-tolualdehyde,benzaldehyde, 4-methyl,para-methylbenzaldehyde,para-toluyl aldehyde |
| IUPAC Name | 4-methylbenzaldehyde |
| InChI Key | FXLOVSHXALFLKQ-UHFFFAOYSA-N |
| Molecular Formula | C8H8O |
2,3,6-Trifluorobenzaldehyde 98.0+%, TCI America™
CAS: 104451-70-9 Molecular Formula: C7H3F3O Molecular Weight (g/mol): 160.10 MDL Number: MFCD00061195 InChI Key: XSBAHBVACIKRTG-UHFFFAOYSA-N Synonym: benzaldehyde, 2,3,6-trifluoro,2,3,6-trifluoro-benzaldehyde,pubchem1467,acmc-1bqm6,2,3,6-trifluorobenzoaldehyde,ksc494g2t,2,3,6-trifluoro benzaldehyde,timtec-bb sbb003970,attercop-chm at111497 PubChem CID: 517845 IUPAC Name: 2,3,6-trifluorobenzaldehyde SMILES: FC1=CC=C(F)C(C=O)=C1F
| PubChem CID | 517845 |
|---|---|
| CAS | 104451-70-9 |
| Molecular Weight (g/mol) | 160.10 |
| MDL Number | MFCD00061195 |
| SMILES | FC1=CC=C(F)C(C=O)=C1F |
| Synonym | benzaldehyde, 2,3,6-trifluoro,2,3,6-trifluoro-benzaldehyde,pubchem1467,acmc-1bqm6,2,3,6-trifluorobenzoaldehyde,ksc494g2t,2,3,6-trifluoro benzaldehyde,timtec-bb sbb003970,attercop-chm at111497 |
| IUPAC Name | 2,3,6-trifluorobenzaldehyde |
| InChI Key | XSBAHBVACIKRTG-UHFFFAOYSA-N |
| Molecular Formula | C7H3F3O |
2,4,6-Trimethylbenzoic Acid 98.0+%, TCI America™
CAS: 480-63-7 Molecular Formula: C10H12O2 Molecular Weight (g/mol): 164.20 MDL Number: MFCD00002481 InChI Key: FFFIRKXTFQCCKJ-UHFFFAOYSA-N Synonym: mesitoic acid,mesitylenecarboxylic acid,beta-isodurylic acid,benzoic acid, 2,4,6-trimethyl,.beta.-isodurylic acid,unii-4pu2hg6787,2-mesitylenecarboxylic acid,2,4,6-trimethyl-benzoic acid,2,6-trimethylbenzoic acid,benzoic acid,4,6-trimethyl PubChem CID: 10194 ChEBI: CHEBI:64830 IUPAC Name: 2,4,6-trimethylbenzoic acid SMILES: CC1=CC(C)=C(C(O)=O)C(C)=C1
| PubChem CID | 10194 |
|---|---|
| CAS | 480-63-7 |
| Molecular Weight (g/mol) | 164.20 |
| ChEBI | CHEBI:64830 |
| MDL Number | MFCD00002481 |
| SMILES | CC1=CC(C)=C(C(O)=O)C(C)=C1 |
| Synonym | mesitoic acid,mesitylenecarboxylic acid,beta-isodurylic acid,benzoic acid, 2,4,6-trimethyl,.beta.-isodurylic acid,unii-4pu2hg6787,2-mesitylenecarboxylic acid,2,4,6-trimethyl-benzoic acid,2,6-trimethylbenzoic acid,benzoic acid,4,6-trimethyl |
| IUPAC Name | 2,4,6-trimethylbenzoic acid |
| InChI Key | FFFIRKXTFQCCKJ-UHFFFAOYSA-N |
| Molecular Formula | C10H12O2 |
Ditridecyl Phthalate (mixture of branched chain isomers), TCI America™
CAS: 75359-31-8 Molecular Formula: C34H58O4 Molecular Weight (g/mol): 530.834 MDL Number: MFCD00048451 InChI Key: YCZJVRCZIPDYHH-UHFFFAOYSA-N Synonym: Phthalic Acid Ditridecyl Ester PubChem CID: 8379 IUPAC Name: ditridecyl benzene-1,2-dicarboxylate SMILES: CCCCCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCCCCCCC
| PubChem CID | 8379 |
|---|---|
| CAS | 75359-31-8 |
| Molecular Weight (g/mol) | 530.834 |
| MDL Number | MFCD00048451 |
| SMILES | CCCCCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCCCCCCC |
| Synonym | Phthalic Acid Ditridecyl Ester |
| IUPAC Name | ditridecyl benzene-1,2-dicarboxylate |
| InChI Key | YCZJVRCZIPDYHH-UHFFFAOYSA-N |
| Molecular Formula | C34H58O4 |
Bis(2,2,2-trifluoroethyl) Phthalate 98.0+%, TCI America™
CAS: 62240-27-1 Molecular Formula: C12H8F6O4 Molecular Weight (g/mol): 330.18 MDL Number: MFCD00059472 InChI Key: PSRBRNHUQJKQHV-UHFFFAOYSA-N Synonym: Phthalic Acid Bis(2,2,2-trifluoroethyl) Ester PubChem CID: 615877 IUPAC Name: 1,2-bis(2,2,2-trifluoroethyl) benzene-1,2-dicarboxylate SMILES: FC(F)(F)COC(=O)C1=CC=CC=C1C(=O)OCC(F)(F)F
| PubChem CID | 615877 |
|---|---|
| CAS | 62240-27-1 |
| Molecular Weight (g/mol) | 330.18 |
| MDL Number | MFCD00059472 |
| SMILES | FC(F)(F)COC(=O)C1=CC=CC=C1C(=O)OCC(F)(F)F |
| Synonym | Phthalic Acid Bis(2,2,2-trifluoroethyl) Ester |
| IUPAC Name | 1,2-bis(2,2,2-trifluoroethyl) benzene-1,2-dicarboxylate |
| InChI Key | PSRBRNHUQJKQHV-UHFFFAOYSA-N |
| Molecular Formula | C12H8F6O4 |
Pentafluorobenzaldehyde 96.0+%, TCI America™
CAS: 653-37-2 Molecular Formula: C7HF5O Molecular Weight (g/mol): 196.076 MDL Number: MFCD00003303 InChI Key: QJXCFMJTJYCLFG-UHFFFAOYSA-N Synonym: pentafluorobenzaldehyde,perfluorobenzaldehyde,benzaldehyde, pentafluoro,benzaldehyde, 2,3,4,5,6-pentafluoro,unii-s9yie3jz4k,pentafluor-benzaldehyd,s9yie3jz4k,pubchem4253,pentafluoro-benzaldehyde,acmc-209nqh PubChem CID: 69558 IUPAC Name: 2,3,4,5,6-pentafluorobenzaldehyde SMILES: C(=O)C1=C(C(=C(C(=C1F)F)F)F)F
| PubChem CID | 69558 |
|---|---|
| CAS | 653-37-2 |
| Molecular Weight (g/mol) | 196.076 |
| MDL Number | MFCD00003303 |
| SMILES | C(=O)C1=C(C(=C(C(=C1F)F)F)F)F |
| Synonym | pentafluorobenzaldehyde,perfluorobenzaldehyde,benzaldehyde, pentafluoro,benzaldehyde, 2,3,4,5,6-pentafluoro,unii-s9yie3jz4k,pentafluor-benzaldehyd,s9yie3jz4k,pubchem4253,pentafluoro-benzaldehyde,acmc-209nqh |
| IUPAC Name | 2,3,4,5,6-pentafluorobenzaldehyde |
| InChI Key | QJXCFMJTJYCLFG-UHFFFAOYSA-N |
| Molecular Formula | C7HF5O |
Biphenyl-4-carboxylic Acid 98.0+%, TCI America™
CAS: 92-92-2 Molecular Formula: C13H10O2 Molecular Weight (g/mol): 198.221 MDL Number: MFCD00002553 InChI Key: NNJMFJSKMRYHSR-UHFFFAOYSA-N Synonym: 4-biphenylcarboxylic acid,biphenyl-4-carboxylic acid,1,1'-biphenyl-4-carboxylic acid,p-phenylbenzoic acid,4-carboxybiphenyl,para phenyl benzoic acid,4-diphenylcarboxylic acid,diphenyl-4-carboxylic acid,4-carboxy-1,1'-biphenyl PubChem CID: 66724 IUPAC Name: 4-phenylbenzoic acid SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O
| PubChem CID | 66724 |
|---|---|
| CAS | 92-92-2 |
| Molecular Weight (g/mol) | 198.221 |
| MDL Number | MFCD00002553 |
| SMILES | C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O |
| Synonym | 4-biphenylcarboxylic acid,biphenyl-4-carboxylic acid,1,1'-biphenyl-4-carboxylic acid,p-phenylbenzoic acid,4-carboxybiphenyl,para phenyl benzoic acid,4-diphenylcarboxylic acid,diphenyl-4-carboxylic acid,4-carboxy-1,1'-biphenyl |
| IUPAC Name | 4-phenylbenzoic acid |
| InChI Key | NNJMFJSKMRYHSR-UHFFFAOYSA-N |
| Molecular Formula | C13H10O2 |
4-n-Octylbenzoic Acid 97.0+%, TCI America™
CAS: 3575-31-3 Molecular Formula: C15H22O2 Molecular Weight (g/mol): 234.339 MDL Number: MFCD00042649 InChI Key: ZQLDNJKHLQOJGE-UHFFFAOYSA-N Synonym: 4-n-octylbenzoic acid,benzoic acid, 4-octyl,p-octylbenzoic acid,para-octylbenzoic acid,benzoic acid, p-octyl,p-n-octyl benzoic acid,p-octyl benzoic acid,4-n-octylbenzoicacid,p-n-octylbenzoic acid,maybridge1_001984 PubChem CID: 19147 IUPAC Name: 4-octylbenzoic acid SMILES: CCCCCCCCC1=CC=C(C=C1)C(=O)O
| PubChem CID | 19147 |
|---|---|
| CAS | 3575-31-3 |
| Molecular Weight (g/mol) | 234.339 |
| MDL Number | MFCD00042649 |
| SMILES | CCCCCCCCC1=CC=C(C=C1)C(=O)O |
| Synonym | 4-n-octylbenzoic acid,benzoic acid, 4-octyl,p-octylbenzoic acid,para-octylbenzoic acid,benzoic acid, p-octyl,p-n-octyl benzoic acid,p-octyl benzoic acid,4-n-octylbenzoicacid,p-n-octylbenzoic acid,maybridge1_001984 |
| IUPAC Name | 4-octylbenzoic acid |
| InChI Key | ZQLDNJKHLQOJGE-UHFFFAOYSA-N |
| Molecular Formula | C15H22O2 |
Terephthalaldehyde 98.0+%, TCI America™
CAS: 623-27-8 Molecular Formula: C8H6O2 Molecular Weight (g/mol): 134.134 MDL Number: MFCD00006949 InChI Key: KUCOHFSKRZZVRO-UHFFFAOYSA-N Synonym: 1,4-benzenedicarboxaldehyde,p-phthalaldehyde,terephthaldehyde,terephthaldialdehyde,terephthaladehyde,terephthaldicarboxaldehyde,terephthalic aldehyde,1,4-phthalaldehyde,p-formylbenzaldehyde,terephtaldehyde PubChem CID: 12173 IUPAC Name: terephthalaldehyde SMILES: C1=CC(=CC=C1C=O)C=O
| PubChem CID | 12173 |
|---|---|
| CAS | 623-27-8 |
| Molecular Weight (g/mol) | 134.134 |
| MDL Number | MFCD00006949 |
| SMILES | C1=CC(=CC=C1C=O)C=O |
| Synonym | 1,4-benzenedicarboxaldehyde,p-phthalaldehyde,terephthaldehyde,terephthaldialdehyde,terephthaladehyde,terephthaldicarboxaldehyde,terephthalic aldehyde,1,4-phthalaldehyde,p-formylbenzaldehyde,terephtaldehyde |
| IUPAC Name | terephthalaldehyde |
| InChI Key | KUCOHFSKRZZVRO-UHFFFAOYSA-N |
| Molecular Formula | C8H6O2 |