Benzene and substituted derivatives
Filtered Search Results
4-Ethylbenzoic Acid 98.0+%, TCI America™
CAS: 619-64-7 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.177 MDL Number: MFCD00002570 InChI Key: ZQVKTHRQIXSMGY-UHFFFAOYSA-N Synonym: benzoic acid, 4-ethyl,p-ethylbenzoic acid,4-ethyl benzoic acid,4-ethyl-benzoic acid,unii-9tkm8p0g6r,9tkm8p0g6r,p-ethylbenzoate,4-ethyl benzoate,4-ethylbenzoicacid,p-ethylbenzoic acid; PubChem CID: 12086 IUPAC Name: 4-ethylbenzoic acid SMILES: CCC1=CC=C(C=C1)C(=O)O
| PubChem CID | 12086 |
|---|---|
| CAS | 619-64-7 |
| Molecular Weight (g/mol) | 150.177 |
| MDL Number | MFCD00002570 |
| SMILES | CCC1=CC=C(C=C1)C(=O)O |
| Synonym | benzoic acid, 4-ethyl,p-ethylbenzoic acid,4-ethyl benzoic acid,4-ethyl-benzoic acid,unii-9tkm8p0g6r,9tkm8p0g6r,p-ethylbenzoate,4-ethyl benzoate,4-ethylbenzoicacid,p-ethylbenzoic acid; |
| IUPAC Name | 4-ethylbenzoic acid |
| InChI Key | ZQVKTHRQIXSMGY-UHFFFAOYSA-N |
| Molecular Formula | C9H10O2 |
2-Bromo-5-chlorobenzaldehyde 97.0+%, TCI America™
CAS: 174265-12-4 Molecular Formula: C7H4BrClO Molecular Weight (g/mol): 219.462 InChI Key: IIISHLMCTDMUHH-UHFFFAOYSA-N Synonym: 5-chloro-2-bromobenzaldehyde,benzaldehyde, 2-bromo-5-chloro,pubchem19849,acmc-1bwmm,ksc174i5n,2-bromo-5-chlorobenzaldehycle,iiishlmctdmuhh-uhfffaoysa PubChem CID: 15391279 IUPAC Name: 2-bromo-5-chlorobenzaldehyde SMILES: C1=CC(=C(C=C1Cl)C=O)Br
| PubChem CID | 15391279 |
|---|---|
| CAS | 174265-12-4 |
| Molecular Weight (g/mol) | 219.462 |
| SMILES | C1=CC(=C(C=C1Cl)C=O)Br |
| Synonym | 5-chloro-2-bromobenzaldehyde,benzaldehyde, 2-bromo-5-chloro,pubchem19849,acmc-1bwmm,ksc174i5n,2-bromo-5-chlorobenzaldehycle,iiishlmctdmuhh-uhfffaoysa |
| IUPAC Name | 2-bromo-5-chlorobenzaldehyde |
| InChI Key | IIISHLMCTDMUHH-UHFFFAOYSA-N |
| Molecular Formula | C7H4BrClO |
4-Bromo-2,6-difluorobenzaldehyde 98.0+%, TCI America™
CAS: 537013-51-7 Molecular Formula: C7H3BrF2O Molecular Weight (g/mol): 221.00 MDL Number: MFCD03094459 InChI Key: CZGVAISJIQNQEJ-UHFFFAOYSA-N Synonym: 4-bromo-2,6-difluorobenzylaldehyde,4-bromo-2,6-difluoro-benzaldehyde,benzaldehyde, 4-bromo-2,6-difluoro,2,6-difluoro-4-bromobenzaldehyde,2,6-difluoro-4-bromo benzaldehyde,pubchem4165,acmc-209l9s,ksc911q5f,4-bromo 2,6-difluorobenzaldehyde,2,6-difluoro-4-bromo-benzaldehyde PubChem CID: 2773290 IUPAC Name: 4-bromo-2,6-difluorobenzaldehyde SMILES: FC1=CC(Br)=CC(F)=C1C=O
| PubChem CID | 2773290 |
|---|---|
| CAS | 537013-51-7 |
| Molecular Weight (g/mol) | 221.00 |
| MDL Number | MFCD03094459 |
| SMILES | FC1=CC(Br)=CC(F)=C1C=O |
| Synonym | 4-bromo-2,6-difluorobenzylaldehyde,4-bromo-2,6-difluoro-benzaldehyde,benzaldehyde, 4-bromo-2,6-difluoro,2,6-difluoro-4-bromobenzaldehyde,2,6-difluoro-4-bromo benzaldehyde,pubchem4165,acmc-209l9s,ksc911q5f,4-bromo 2,6-difluorobenzaldehyde,2,6-difluoro-4-bromo-benzaldehyde |
| IUPAC Name | 4-bromo-2,6-difluorobenzaldehyde |
| InChI Key | CZGVAISJIQNQEJ-UHFFFAOYSA-N |
| Molecular Formula | C7H3BrF2O |
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 |
Diethyl 4,4'-Biphenyldicarboxylate 98.0+%, TCI America™
CAS: 47230-38-6 Molecular Formula: C18H18O4 Molecular Weight (g/mol): 298.34 MDL Number: MFCD00017270 InChI Key: SYTZNHBXNLYWAK-UHFFFAOYSA-N Synonym: diethyl 4,4'-biphenyldicarboxylate,diethyl biphenyl-4,4'-dicarboxylate,diethyl 1,1'-biphenyl-4,4'-dicarboxylate,ethyl 4-4-ethoxycarbonylphenyl benzoate,diethyl-4,4'-diphenyldicarboxylate,diethyl biphenyl 4,4'-dicarboxylate,ethyl 4-4-ethoxycarbonyl phenyl benzoate,4,4'-biphenyldicarboxylic acid diethyl ester,4,4'-diethyl 1,1'-biphenyl-4,4'-dicarboxylate,acmc-1apwf PubChem CID: 261553 IUPAC Name: 4,4'-diethyl [1,1'-biphenyl]-4,4'-dicarboxylate SMILES: CCOC(=O)C1=CC=C(C=C1)C1=CC=C(C=C1)C(=O)OCC
| PubChem CID | 261553 |
|---|---|
| CAS | 47230-38-6 |
| Molecular Weight (g/mol) | 298.34 |
| MDL Number | MFCD00017270 |
| SMILES | CCOC(=O)C1=CC=C(C=C1)C1=CC=C(C=C1)C(=O)OCC |
| Synonym | diethyl 4,4'-biphenyldicarboxylate,diethyl biphenyl-4,4'-dicarboxylate,diethyl 1,1'-biphenyl-4,4'-dicarboxylate,ethyl 4-4-ethoxycarbonylphenyl benzoate,diethyl-4,4'-diphenyldicarboxylate,diethyl biphenyl 4,4'-dicarboxylate,ethyl 4-4-ethoxycarbonyl phenyl benzoate,4,4'-biphenyldicarboxylic acid diethyl ester,4,4'-diethyl 1,1'-biphenyl-4,4'-dicarboxylate,acmc-1apwf |
| IUPAC Name | 4,4'-diethyl [1,1'-biphenyl]-4,4'-dicarboxylate |
| InChI Key | SYTZNHBXNLYWAK-UHFFFAOYSA-N |
| Molecular Formula | C18H18O4 |
2,4,6-Trimethoxybenzaldehyde 98.0+%, TCI America™
CAS: 830-79-5 Molecular Formula: C10H12O4 Molecular Weight (g/mol): 196.202 MDL Number: MFCD00003313 InChI Key: CRBZVDLXAIFERF-UHFFFAOYSA-N Synonym: benzaldehyde, 2,4,6-trimethoxy,2,4,6-trimethoxybenz aldehyde,pubchem8264,acmc-1cuhn,ksc490m2h,2,4,6-trimethoxy-benzaldehyde,2,4,6-trimethoxybenz-aldehyde,2,4,6-trimethoxy benz aldehyde,crbzvdlxaiferf-uhfffaoysa,1-formyl-2,4,6-trimethoxybenzene PubChem CID: 70019 IUPAC Name: 2,4,6-trimethoxybenzaldehyde SMILES: COC1=CC(=C(C(=C1)OC)C=O)OC
| PubChem CID | 70019 |
|---|---|
| CAS | 830-79-5 |
| Molecular Weight (g/mol) | 196.202 |
| MDL Number | MFCD00003313 |
| SMILES | COC1=CC(=C(C(=C1)OC)C=O)OC |
| Synonym | benzaldehyde, 2,4,6-trimethoxy,2,4,6-trimethoxybenz aldehyde,pubchem8264,acmc-1cuhn,ksc490m2h,2,4,6-trimethoxy-benzaldehyde,2,4,6-trimethoxybenz-aldehyde,2,4,6-trimethoxy benz aldehyde,crbzvdlxaiferf-uhfffaoysa,1-formyl-2,4,6-trimethoxybenzene |
| IUPAC Name | 2,4,6-trimethoxybenzaldehyde |
| InChI Key | CRBZVDLXAIFERF-UHFFFAOYSA-N |
| Molecular Formula | C10H12O4 |
5-Bromo-2-fluorobenzaldehyde 95.0+%, TCI America™
CAS: 93777-26-5 Molecular Formula: C7H4BrFO Molecular Weight (g/mol): 203.01 MDL Number: MFCD00070755 InChI Key: MMFGGDVQLQQQRX-UHFFFAOYSA-N Synonym: 2-fluoro-5-bromobenzaldehyde,5-bromo-2-fluoro-benzaldehyde,2-fluoro-5-bromo benzaldehyde,5-bromo-2-fluoro benzaldehyde,benzaldehyde, 5-bromo-2-fluoro,5-brom-2-fluorbenzaldehyd,pubchem2879,acmc-209rnk,3-bromo-6-fluorobenzaldehyde,ksc494e9t PubChem CID: 736327 IUPAC Name: 5-bromo-2-fluorobenzaldehyde SMILES: C1=CC(=C(C=C1Br)C=O)F
| PubChem CID | 736327 |
|---|---|
| CAS | 93777-26-5 |
| Molecular Weight (g/mol) | 203.01 |
| MDL Number | MFCD00070755 |
| SMILES | C1=CC(=C(C=C1Br)C=O)F |
| Synonym | 2-fluoro-5-bromobenzaldehyde,5-bromo-2-fluoro-benzaldehyde,2-fluoro-5-bromo benzaldehyde,5-bromo-2-fluoro benzaldehyde,benzaldehyde, 5-bromo-2-fluoro,5-brom-2-fluorbenzaldehyd,pubchem2879,acmc-209rnk,3-bromo-6-fluorobenzaldehyde,ksc494e9t |
| IUPAC Name | 5-bromo-2-fluorobenzaldehyde |
| InChI Key | MMFGGDVQLQQQRX-UHFFFAOYSA-N |
| Molecular Formula | C7H4BrFO |
2,2'-Biphenyldicarboxylic Acid 98.0+%, TCI America™
CAS: 482-05-3 Molecular Formula: C14H10O4 Molecular Weight (g/mol): 242.23 MDL Number: MFCD00002464 InChI Key: GWZCCUDJHOGOSO-UHFFFAOYSA-N Synonym: diphenic acid,1,1'-biphenyl-2,2'-dicarboxylic acid,2,2'-biphenyldicarboxylic acid,2,2'-bibenzoic acid,biphenyl-2,2'-dicarboxylic acid,2,2'-dicarboxybiphenyl,2,2'-diphenic acid,2-2-carboxyphenyl benzoic acid,o,o'-diphenic acid,o,o'-bibenzoic acid PubChem CID: 10210 ChEBI: CHEBI:23837 IUPAC Name: 2-(2-carboxyphenyl)benzoic acid SMILES: C1=CC=C(C(=C1)C2=CC=CC=C2C(=O)O)C(=O)O
| PubChem CID | 10210 |
|---|---|
| CAS | 482-05-3 |
| Molecular Weight (g/mol) | 242.23 |
| ChEBI | CHEBI:23837 |
| MDL Number | MFCD00002464 |
| SMILES | C1=CC=C(C(=C1)C2=CC=CC=C2C(=O)O)C(=O)O |
| Synonym | diphenic acid,1,1'-biphenyl-2,2'-dicarboxylic acid,2,2'-biphenyldicarboxylic acid,2,2'-bibenzoic acid,biphenyl-2,2'-dicarboxylic acid,2,2'-dicarboxybiphenyl,2,2'-diphenic acid,2-2-carboxyphenyl benzoic acid,o,o'-diphenic acid,o,o'-bibenzoic acid |
| IUPAC Name | 2-(2-carboxyphenyl)benzoic acid |
| InChI Key | GWZCCUDJHOGOSO-UHFFFAOYSA-N |
| Molecular Formula | C14H10O4 |
Dinonyl Phthalate (mixture of isomers) 95.0+%, TCI America™
CAS: 84-76-4 Molecular Formula: C26H42O4 Molecular Weight (g/mol): 418.62 MDL Number: MFCD00036237 InChI Key: DROMNWUQASBTFM-UHFFFAOYSA-N Synonym: dinonyl phthalate,dinonylphthalate,nonyl phthalate,di-n-nonyl phthalate,bisoflex dnp,unimoll dn,bisoflex 91,phthalic acid, dinonyl ester,1,2-benzenedicarboxylic acid, dinonyl ester,bisolflex 91 PubChem CID: 6787 IUPAC Name: 1,2-dinonyl benzene-1,2-dicarboxylate SMILES: CCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCCC
| PubChem CID | 6787 |
|---|---|
| CAS | 84-76-4 |
| Molecular Weight (g/mol) | 418.62 |
| MDL Number | MFCD00036237 |
| SMILES | CCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCCC |
| Synonym | dinonyl phthalate,dinonylphthalate,nonyl phthalate,di-n-nonyl phthalate,bisoflex dnp,unimoll dn,bisoflex 91,phthalic acid, dinonyl ester,1,2-benzenedicarboxylic acid, dinonyl ester,bisolflex 91 |
| IUPAC Name | 1,2-dinonyl benzene-1,2-dicarboxylate |
| InChI Key | DROMNWUQASBTFM-UHFFFAOYSA-N |
| Molecular Formula | C26H42O4 |
(-)-Dibenzoyl-L-tartaric Acid Monohydrate 98.0+%, TCI America™
CAS: 62708-56-9 Molecular Formula: C18H14O8 Molecular Weight (g/mol): 358.30 MDL Number: MFCD00149119 InChI Key: YONLFQNRGZXBBF-OKILXGFUSA-N Synonym: 2r,3r-2,3-bis benzoyloxy succinic acid hydrate,--dibenzoyl-l-tartaric acid monohydrate,--dibenzoyl-l-tartaric acidmonohydrate,dibenzoyl-l---tartaric acid monohydrate,l--dibenzoyl-l-tartatic acid monohydrate,2r,3r---dibenzoyl-l-tartaric acid monohydrate,2r,3r-2,3-bis benzoyloxy butanedioic acid hydrate,dibenzoyl-l-tartaric acid monohydrate,l-dbta,pubchem7152 PubChem CID: 44119738 IUPAC Name: (2R,3S)-2,3-bis(benzoyloxy)butanedioic acid SMILES: OC(=O)[C@@H](OC(=O)C1=CC=CC=C1)[C@@H](OC(=O)C1=CC=CC=C1)C(O)=O
| PubChem CID | 44119738 |
|---|---|
| CAS | 62708-56-9 |
| Molecular Weight (g/mol) | 358.30 |
| MDL Number | MFCD00149119 |
| SMILES | OC(=O)[C@@H](OC(=O)C1=CC=CC=C1)[C@@H](OC(=O)C1=CC=CC=C1)C(O)=O |
| Synonym | 2r,3r-2,3-bis benzoyloxy succinic acid hydrate,--dibenzoyl-l-tartaric acid monohydrate,--dibenzoyl-l-tartaric acidmonohydrate,dibenzoyl-l---tartaric acid monohydrate,l--dibenzoyl-l-tartatic acid monohydrate,2r,3r---dibenzoyl-l-tartaric acid monohydrate,2r,3r-2,3-bis benzoyloxy butanedioic acid hydrate,dibenzoyl-l-tartaric acid monohydrate,l-dbta,pubchem7152 |
| IUPAC Name | (2R,3S)-2,3-bis(benzoyloxy)butanedioic acid |
| InChI Key | YONLFQNRGZXBBF-OKILXGFUSA-N |
| Molecular Formula | C18H14O8 |
| PubChem CID | 2778654 |
|---|---|
| CAS | 248270-25-9 |
| Molecular Weight (g/mol) | 167.93 |
| MDL Number | MFCD02093051 |
| Color | White-Yellow |
| Physical Form | Crystalline Powder |
| SMILES | B(C1=CC(=C(C=C1)C=O)F)(O)O |
| TSCA | No |
| IUPAC Name | (3-fluoro-4-formylphenyl)boronic acid |
| InChI Key | NZNRMUVHUVCIBR-UHFFFAOYSA-N |
| Molecular Formula | C7H6BFO3 |
| Formula Weight | 167.93 |
| Melting Point | 240°C |
3-Cyanobenzoic Acid 98.0+%, TCI America™
CAS: 1877-72-1 Molecular Formula: C8H5NO2 Molecular Weight (g/mol): 147.133 MDL Number: MFCD00002486 InChI Key: GYLKKXHEIIFTJH-UHFFFAOYSA-N Synonym: m-cyanobenzoic acid,benzoic acid, 3-cyano,3-carboxybenzonitrile,3-cyano-benzoic acid,3-cyanobenzoicacid,benzoic acid, m-cyano,unii-d2gc692d78,3-cyano-benzoicacid,m-carboxybenzonitrile,3-cyano benzoic acid PubChem CID: 15875 IUPAC Name: 3-cyanobenzoic acid SMILES: C1=CC(=CC(=C1)C(=O)O)C#N
| PubChem CID | 15875 |
|---|---|
| CAS | 1877-72-1 |
| Molecular Weight (g/mol) | 147.133 |
| MDL Number | MFCD00002486 |
| SMILES | C1=CC(=CC(=C1)C(=O)O)C#N |
| Synonym | m-cyanobenzoic acid,benzoic acid, 3-cyano,3-carboxybenzonitrile,3-cyano-benzoic acid,3-cyanobenzoicacid,benzoic acid, m-cyano,unii-d2gc692d78,3-cyano-benzoicacid,m-carboxybenzonitrile,3-cyano benzoic acid |
| IUPAC Name | 3-cyanobenzoic acid |
| InChI Key | GYLKKXHEIIFTJH-UHFFFAOYSA-N |
| Molecular Formula | C8H5NO2 |
Hexyl Benzoate 98.0+%, TCI America™
CAS: 6789-88-4 Molecular Formula: C13H18O2 Molecular Weight (g/mol): 206.285 MDL Number: MFCD00051714 InChI Key: UUGLJVMIFJNVFH-UHFFFAOYSA-N Synonym: benzoic acid, hexyl ester,benzoic acid n-hexyl ester,n-hexylbenzoate,n-hexyl benzoate,1-hexyl benzoate,hexylbenzoate,hexylester kyseliny benzoove,benzoic acid hexyl ester,unii-vr3c36ekjr,fema no. 3691 PubChem CID: 23235 IUPAC Name: hexyl benzoate SMILES: CCCCCCOC(=O)C1=CC=CC=C1
| PubChem CID | 23235 |
|---|---|
| CAS | 6789-88-4 |
| Molecular Weight (g/mol) | 206.285 |
| MDL Number | MFCD00051714 |
| SMILES | CCCCCCOC(=O)C1=CC=CC=C1 |
| Synonym | benzoic acid, hexyl ester,benzoic acid n-hexyl ester,n-hexylbenzoate,n-hexyl benzoate,1-hexyl benzoate,hexylbenzoate,hexylester kyseliny benzoove,benzoic acid hexyl ester,unii-vr3c36ekjr,fema no. 3691 |
| IUPAC Name | hexyl benzoate |
| InChI Key | UUGLJVMIFJNVFH-UHFFFAOYSA-N |
| Molecular Formula | C13H18O2 |
3-Fluorobenzaldehyde 97.0+%, TCI America™
CAS: 456-48-4 Molecular Formula: C7H5FO Molecular Weight (g/mol): 124.114 MDL Number: MFCD00003348 InChI Key: PIKNVEVCWAAOMJ-UHFFFAOYSA-N Synonym: m-fluorobenzaldehyde,benzaldehyde, 3-fluoro,3'-fluoro-benzaldehyde,3-fluoro-benzaldehyde,meta-fluorobenzaldehyde,benzaldehyde, m-fluoro,3-fc6h4cho,3-fluorobenzaldehyde,3-fluoro benzaldehyde,pubchem3477 PubChem CID: 68009 IUPAC Name: 3-fluorobenzaldehyde SMILES: C1=CC(=CC(=C1)F)C=O
| PubChem CID | 68009 |
|---|---|
| CAS | 456-48-4 |
| Molecular Weight (g/mol) | 124.114 |
| MDL Number | MFCD00003348 |
| SMILES | C1=CC(=CC(=C1)F)C=O |
| Synonym | m-fluorobenzaldehyde,benzaldehyde, 3-fluoro,3'-fluoro-benzaldehyde,3-fluoro-benzaldehyde,meta-fluorobenzaldehyde,benzaldehyde, m-fluoro,3-fc6h4cho,3-fluorobenzaldehyde,3-fluoro benzaldehyde,pubchem3477 |
| IUPAC Name | 3-fluorobenzaldehyde |
| InChI Key | PIKNVEVCWAAOMJ-UHFFFAOYSA-N |
| Molecular Formula | C7H5FO |
3-Methyl-2-butenyl Benzoate 98.0+%, TCI America™
CAS: 5205-11-8 Molecular Formula: C12H14O2 Molecular Weight (g/mol): 190.24 MDL Number: MFCD00036570 InChI Key: INVWRXWYYVMFQC-UHFFFAOYSA-N Synonym: Benzoic Acid 3-Methyl-2-butenyl Ester, Benzoic Acid Prenyl Ester, Prenyl Benzoate PubChem CID: 21265 IUPAC Name: 3-methylbut-2-enyl benzoate SMILES: CC(=CCOC(=O)C1=CC=CC=C1)C
| PubChem CID | 21265 |
|---|---|
| CAS | 5205-11-8 |
| Molecular Weight (g/mol) | 190.24 |
| MDL Number | MFCD00036570 |
| SMILES | CC(=CCOC(=O)C1=CC=CC=C1)C |
| Synonym | Benzoic Acid 3-Methyl-2-butenyl Ester, Benzoic Acid Prenyl Ester, Prenyl Benzoate |
| IUPAC Name | 3-methylbut-2-enyl benzoate |
| InChI Key | INVWRXWYYVMFQC-UHFFFAOYSA-N |
| Molecular Formula | C12H14O2 |