Benzene and substituted derivatives
Filtered Search Results
n-Octyl 4-Hydroxybenzoate 98.0+%, TCI America™
CAS: 1219-38-1 Molecular Formula: C15H22O3 Molecular Weight (g/mol): 250.34 MDL Number: MFCD00016482 InChI Key: RIKCMEDSBFQFAL-UHFFFAOYSA-N Synonym: octylparaben,n-octyl 4-hydroxybenzoate,octyl paraben,octyl p-hydroxybenzoate,p-hydroxybenzoic acid octyl ester,benzoic acid, 4-hydroxy-, octyl ester,p-oxybenzoesaureoctylester,4-hydroxybenzoic acid n-octyl ester,unii-4uvk431k6b,p-oxybenzoesaureoctylester german PubChem CID: 14642 IUPAC Name: octyl 4-hydroxybenzoate SMILES: CCCCCCCCOC(=O)C1=CC=C(O)C=C1
| PubChem CID | 14642 |
|---|---|
| CAS | 1219-38-1 |
| Molecular Weight (g/mol) | 250.34 |
| MDL Number | MFCD00016482 |
| SMILES | CCCCCCCCOC(=O)C1=CC=C(O)C=C1 |
| Synonym | octylparaben,n-octyl 4-hydroxybenzoate,octyl paraben,octyl p-hydroxybenzoate,p-hydroxybenzoic acid octyl ester,benzoic acid, 4-hydroxy-, octyl ester,p-oxybenzoesaureoctylester,4-hydroxybenzoic acid n-octyl ester,unii-4uvk431k6b,p-oxybenzoesaureoctylester german |
| IUPAC Name | octyl 4-hydroxybenzoate |
| InChI Key | RIKCMEDSBFQFAL-UHFFFAOYSA-N |
| Molecular Formula | C15H22O3 |
3-Fluoro-4-n-octyloxybenzoic Acid 97.0+%, TCI America™
CAS: 326-78-3 Molecular Formula: C15H21FO3 Molecular Weight (g/mol): 268.328 MDL Number: MFCD00191649 InChI Key: SQVFTDZEUGEJTQ-UHFFFAOYSA-N PubChem CID: 593523 IUPAC Name: 3-fluoro-4-octoxybenzoic acid SMILES: CCCCCCCCOC1=C(C=C(C=C1)C(=O)O)F
| PubChem CID | 593523 |
|---|---|
| CAS | 326-78-3 |
| Molecular Weight (g/mol) | 268.328 |
| MDL Number | MFCD00191649 |
| SMILES | CCCCCCCCOC1=C(C=C(C=C1)C(=O)O)F |
| IUPAC Name | 3-fluoro-4-octoxybenzoic acid |
| InChI Key | SQVFTDZEUGEJTQ-UHFFFAOYSA-N |
| Molecular Formula | C15H21FO3 |
1-Fluoro-3-(trifluoromethoxy)benzene 98.0+%, TCI America™
CAS: 1077-01-6 Molecular Formula: C7H4F4O Molecular Weight (g/mol): 180.102 MDL Number: MFCD00236323 InChI Key: AUKDFDQPJWJEDH-UHFFFAOYSA-N PubChem CID: 2777286 IUPAC Name: 1-fluoro-3-(trifluoromethoxy)benzene SMILES: C1=CC(=CC(=C1)F)OC(F)(F)F
| PubChem CID | 2777286 |
|---|---|
| CAS | 1077-01-6 |
| Molecular Weight (g/mol) | 180.102 |
| MDL Number | MFCD00236323 |
| SMILES | C1=CC(=CC(=C1)F)OC(F)(F)F |
| IUPAC Name | 1-fluoro-3-(trifluoromethoxy)benzene |
| InChI Key | AUKDFDQPJWJEDH-UHFFFAOYSA-N |
| Molecular Formula | C7H4F4O |
4-(4-Fluorophenylethynyl)phenol 98.0+%, TCI America™
CAS: 197770-48-2 Molecular Formula: C14H9FO Molecular Weight (g/mol): 212.223 MDL Number: MFCD02093472 InChI Key: LIPHCUGEWJPCQB-UHFFFAOYSA-N Synonym: 1-(4-Fluorophenyl)-2-(4-hydroxyphenyl)acetylene PubChem CID: 2782365 IUPAC Name: 4-[2-(4-fluorophenyl)ethynyl]phenol SMILES: C1=CC(=CC=C1C#CC2=CC=C(C=C2)F)O
| PubChem CID | 2782365 |
|---|---|
| CAS | 197770-48-2 |
| Molecular Weight (g/mol) | 212.223 |
| MDL Number | MFCD02093472 |
| SMILES | C1=CC(=CC=C1C#CC2=CC=C(C=C2)F)O |
| Synonym | 1-(4-Fluorophenyl)-2-(4-hydroxyphenyl)acetylene |
| IUPAC Name | 4-[2-(4-fluorophenyl)ethynyl]phenol |
| InChI Key | LIPHCUGEWJPCQB-UHFFFAOYSA-N |
| Molecular Formula | C14H9FO |
2-(4-Fluorophenyl)ethyl Bromide 95.0+%, TCI America™
CAS: 332-42-3 Molecular Formula: C8H8BrF Molecular Weight (g/mol): 203.05 MDL Number: MFCD03844794 InChI Key: FLRUNCJXOVYWDH-UHFFFAOYSA-N Synonym: 1-2-bromoethyl-4-fluorobenzene,1-fluoro-4-2-bromoethyl benzene,4-fluorophenethyl bromide,2-4-fluorophenyl ethyl bromide,1-bromo-2-4-fluorophenyl ethane,2-4-fluorophenyl ethylbromide,4-fluorophenylethyl bromide,1-2-bromo-ethyl-4-fluoro-benzene,benzene, 1-2-bromoethyl-4-fluoro,1-2-bromoethyl-4-fluoro-benzene PubChem CID: 573153 IUPAC Name: 1-(2-bromoethyl)-4-fluorobenzene SMILES: FC1=CC=C(CCBr)C=C1
| PubChem CID | 573153 |
|---|---|
| CAS | 332-42-3 |
| Molecular Weight (g/mol) | 203.05 |
| MDL Number | MFCD03844794 |
| SMILES | FC1=CC=C(CCBr)C=C1 |
| Synonym | 1-2-bromoethyl-4-fluorobenzene,1-fluoro-4-2-bromoethyl benzene,4-fluorophenethyl bromide,2-4-fluorophenyl ethyl bromide,1-bromo-2-4-fluorophenyl ethane,2-4-fluorophenyl ethylbromide,4-fluorophenylethyl bromide,1-2-bromo-ethyl-4-fluoro-benzene,benzene, 1-2-bromoethyl-4-fluoro,1-2-bromoethyl-4-fluoro-benzene |
| IUPAC Name | 1-(2-bromoethyl)-4-fluorobenzene |
| InChI Key | FLRUNCJXOVYWDH-UHFFFAOYSA-N |
| Molecular Formula | C8H8BrF |
Ethyl 4-Phenoxybutyrate 96.0+%, TCI America™
CAS: 2364-59-2 Molecular Formula: C12H16O3 Molecular Weight (g/mol): 208.257 MDL Number: MFCD01321182 InChI Key: XSVIVXBQBFMYCS-UHFFFAOYSA-N Synonym: 4-Phenoxybutyric Acid Ethyl Ester PubChem CID: 222539 IUPAC Name: ethyl 4-phenoxybutanoate SMILES: CCOC(=O)CCCOC1=CC=CC=C1
| PubChem CID | 222539 |
|---|---|
| CAS | 2364-59-2 |
| Molecular Weight (g/mol) | 208.257 |
| MDL Number | MFCD01321182 |
| SMILES | CCOC(=O)CCCOC1=CC=CC=C1 |
| Synonym | 4-Phenoxybutyric Acid Ethyl Ester |
| IUPAC Name | ethyl 4-phenoxybutanoate |
| InChI Key | XSVIVXBQBFMYCS-UHFFFAOYSA-N |
| Molecular Formula | C12H16O3 |
N-Ethyl-o-toluidine 98.0+%, TCI America™
CAS: 94-68-8 Molecular Formula: C9H13N Molecular Weight (g/mol): 135.21 MDL Number: MFCD00026695 InChI Key: MWOUGPLLVVEUMM-UHFFFAOYSA-N Synonym: n-ethyl-o-toluidine,2-ethylamino toluene,2-ethylaminotoluene,benzenamine, n-ethyl-2-methyl,o-methyl-n-ethylaniline,1-ethylamino-2-methylbenzene,n-ethyl-2-methyl-aniline,n-ethyl-2-aminotoluene,o-toluidine, n-ethyl,n-ethyl-2-toluidine PubChem CID: 7201 IUPAC Name: N-ethyl-2-methylaniline SMILES: CCNC1=CC=CC=C1C
| PubChem CID | 7201 |
|---|---|
| CAS | 94-68-8 |
| Molecular Weight (g/mol) | 135.21 |
| MDL Number | MFCD00026695 |
| SMILES | CCNC1=CC=CC=C1C |
| Synonym | n-ethyl-o-toluidine,2-ethylamino toluene,2-ethylaminotoluene,benzenamine, n-ethyl-2-methyl,o-methyl-n-ethylaniline,1-ethylamino-2-methylbenzene,n-ethyl-2-methyl-aniline,n-ethyl-2-aminotoluene,o-toluidine, n-ethyl,n-ethyl-2-toluidine |
| IUPAC Name | N-ethyl-2-methylaniline |
| InChI Key | MWOUGPLLVVEUMM-UHFFFAOYSA-N |
| Molecular Formula | C9H13N |
2-Ethoxybenzoic Acid 98.0+%, TCI America™
CAS: 134-11-2 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00002438 InChI Key: XDZMPRGFOOFSBL-UHFFFAOYSA-N Synonym: o-ethoxybenzoic acid,benzoic acid, 2-ethoxy,benzoic acid, o-ethoxy,o-ethylsalicylic acid,benzoic acid, ethoxy,2'-carboxyphenetole,2-ethoxy benzoic acid,2-ethoxy-benzoic acid,pubchem20122,ortho-ethoxybenzoic acid PubChem CID: 67252 IUPAC Name: 2-ethoxybenzoic acid SMILES: CCOC1=CC=CC=C1C(O)=O
| PubChem CID | 67252 |
|---|---|
| CAS | 134-11-2 |
| Molecular Weight (g/mol) | 166.18 |
| MDL Number | MFCD00002438 |
| SMILES | CCOC1=CC=CC=C1C(O)=O |
| Synonym | o-ethoxybenzoic acid,benzoic acid, 2-ethoxy,benzoic acid, o-ethoxy,o-ethylsalicylic acid,benzoic acid, ethoxy,2'-carboxyphenetole,2-ethoxy benzoic acid,2-ethoxy-benzoic acid,pubchem20122,ortho-ethoxybenzoic acid |
| IUPAC Name | 2-ethoxybenzoic acid |
| InChI Key | XDZMPRGFOOFSBL-UHFFFAOYSA-N |
| Molecular Formula | C9H10O3 |
2-Fluoro-5-methylbenzonitrile 98.0+%, TCI America™
CAS: 64113-84-4 Molecular Formula: C8H6FN Molecular Weight (g/mol): 135.141 MDL Number: MFCD00134542 InChI Key: CMAOLVNGLTWICC-UHFFFAOYSA-N Synonym: 6-fluoro-m-tolunitrile,benzonitrile, 2-fluoro-5-methyl,2-fluoro-5-methyl-benzonitrile,3-cyano-4-fluorotoluene,2-fluoro-5-methylbenzenecarbonitrile,pubchem1552,acmc-209nk8,ksc352m4h,2-fluoro-5 methyl benzonitrile,2-fluoro-5-methyl benzonitrile PubChem CID: 2774584 IUPAC Name: 2-fluoro-5-methylbenzonitrile SMILES: CC1=CC(=C(C=C1)F)C#N
| PubChem CID | 2774584 |
|---|---|
| CAS | 64113-84-4 |
| Molecular Weight (g/mol) | 135.141 |
| MDL Number | MFCD00134542 |
| SMILES | CC1=CC(=C(C=C1)F)C#N |
| Synonym | 6-fluoro-m-tolunitrile,benzonitrile, 2-fluoro-5-methyl,2-fluoro-5-methyl-benzonitrile,3-cyano-4-fluorotoluene,2-fluoro-5-methylbenzenecarbonitrile,pubchem1552,acmc-209nk8,ksc352m4h,2-fluoro-5 methyl benzonitrile,2-fluoro-5-methyl benzonitrile |
| IUPAC Name | 2-fluoro-5-methylbenzonitrile |
| InChI Key | CMAOLVNGLTWICC-UHFFFAOYSA-N |
| Molecular Formula | C8H6FN |
1-Fluoro-4-iodobenzene (stabilized with Copper chip) 98.0+%, TCI America™
CAS: 352-34-1 Molecular Formula: C6H4FI Molecular Weight (g/mol): 222.00 MDL Number: MFCD00001052 InChI Key: KGNQDBQYEBMPFZ-UHFFFAOYSA-N Synonym: 4-fluoroiodobenzene,p-fluoroiodobenzene,benzene, 1-fluoro-4-iodo,4-iodofluorobenzene,p-iodofluorobenzene,4-fluoro-1-iodobenzene,4-fluoro-iodobenzene,1-fluoro-4-iodo-benzene,1-iodo-4-fluorobenzene,4-fluroiodobenzene PubChem CID: 9605 IUPAC Name: 1-fluoro-4-iodobenzene SMILES: FC1=CC=C(I)C=C1
| PubChem CID | 9605 |
|---|---|
| CAS | 352-34-1 |
| Molecular Weight (g/mol) | 222.00 |
| MDL Number | MFCD00001052 |
| SMILES | FC1=CC=C(I)C=C1 |
| Synonym | 4-fluoroiodobenzene,p-fluoroiodobenzene,benzene, 1-fluoro-4-iodo,4-iodofluorobenzene,p-iodofluorobenzene,4-fluoro-1-iodobenzene,4-fluoro-iodobenzene,1-fluoro-4-iodo-benzene,1-iodo-4-fluorobenzene,4-fluroiodobenzene |
| IUPAC Name | 1-fluoro-4-iodobenzene |
| InChI Key | KGNQDBQYEBMPFZ-UHFFFAOYSA-N |
| Molecular Formula | C6H4FI |
2-Fluoro-4,5-dimethoxybenzonitrile 98.0+%, TCI America™
CAS: 119396-88-2 Molecular Formula: C9H8FNO2 Molecular Weight (g/mol): 181.166 MDL Number: MFCD00143236 InChI Key: QZKGCLSVCWWARO-UHFFFAOYSA-N Synonym: 4-Cyano-5-fluoroveratrole PubChem CID: 2774258 IUPAC Name: 2-fluoro-4,5-dimethoxybenzonitrile SMILES: COC1=C(C=C(C(=C1)C#N)F)OC
| PubChem CID | 2774258 |
|---|---|
| CAS | 119396-88-2 |
| Molecular Weight (g/mol) | 181.166 |
| MDL Number | MFCD00143236 |
| SMILES | COC1=C(C=C(C(=C1)C#N)F)OC |
| Synonym | 4-Cyano-5-fluoroveratrole |
| IUPAC Name | 2-fluoro-4,5-dimethoxybenzonitrile |
| InChI Key | QZKGCLSVCWWARO-UHFFFAOYSA-N |
| Molecular Formula | C9H8FNO2 |
| PubChem CID | 2733986 |
|---|---|
| CAS | 768-35-4 |
| Molecular Weight (g/mol) | 139.92 |
| MDL Number | MFCD00236042 |
| Physical Form | Crystalline Powder |
| TSCA | No |
| IUPAC Name | (3-fluorophenyl)boronic acid |
| InChI Key | KNXQDJCZSVHEIW-UHFFFAOYSA-N |
| Molecular Formula | C6H6BFO2 |
| Formula Weight | 139.92 |
| PubChem CID | 2734665 |
|---|---|
| CAS | 139911-29-8 |
| Molecular Weight (g/mol) | 153.947 |
| MDL Number | MFCD02093072 |
| Color | White-Yellow |
| Physical Form | Crystalline Powder |
| SMILES | B(C1=C(C=C(C=C1)F)C)(O)O |
| TSCA | No |
| IUPAC Name | (4-fluoro-2-methylphenyl)boronic acid |
| InChI Key | IQMLIVUHMSIOQP-UHFFFAOYSA-N |
| Molecular Formula | C7H8BFO2 |
| Formula Weight | 153.95 |
| Melting Point | 201°C |
4-Fluorophenetole 98.0+%, TCI America™
CAS: 459-26-7 Molecular Formula: C8H9FO Molecular Weight (g/mol): 140.157 MDL Number: MFCD00017953 InChI Key: PURLWQWDGIIYBG-UHFFFAOYSA-N Synonym: 1-Ethoxy-4-fluorobenzene PubChem CID: 68018 IUPAC Name: 1-ethoxy-4-fluorobenzene SMILES: CCOC1=CC=C(C=C1)F
| PubChem CID | 68018 |
|---|---|
| CAS | 459-26-7 |
| Molecular Weight (g/mol) | 140.157 |
| MDL Number | MFCD00017953 |
| SMILES | CCOC1=CC=C(C=C1)F |
| Synonym | 1-Ethoxy-4-fluorobenzene |
| IUPAC Name | 1-ethoxy-4-fluorobenzene |
| InChI Key | PURLWQWDGIIYBG-UHFFFAOYSA-N |
| Molecular Formula | C8H9FO |
3-Fluoro-4-methylphenylboronic Acid (contains varying amounts of Anhydride) 97.0+%, TCI America™
CAS: 168267-99-0 Molecular Formula: C7H8BFO2 Molecular Weight (g/mol): 153.947 MDL Number: MFCD02683115 InChI Key: WPVBHUUZDFUIJA-UHFFFAOYSA-N Synonym: 3-fluoro-4-methylbenzeneboronic acid,3-fluoro-4-methylphenyl boronic acid,3-fluoro-p-tolylboronic acid,3-fluoro-4-methylphenyl-boronic acid,boronic acid, 3-fluoro-4-methylphenyl,pubchem5124,3-fluoro-4-methyl-phenyl boronic acid,acmc-209dxx,ksc173s0n PubChem CID: 2782674 IUPAC Name: (3-fluoro-4-methylphenyl)boronic acid SMILES: B(C1=CC(=C(C=C1)C)F)(O)O
| PubChem CID | 2782674 |
|---|---|
| CAS | 168267-99-0 |
| Molecular Weight (g/mol) | 153.947 |
| MDL Number | MFCD02683115 |
| SMILES | B(C1=CC(=C(C=C1)C)F)(O)O |
| Synonym | 3-fluoro-4-methylbenzeneboronic acid,3-fluoro-4-methylphenyl boronic acid,3-fluoro-p-tolylboronic acid,3-fluoro-4-methylphenyl-boronic acid,boronic acid, 3-fluoro-4-methylphenyl,pubchem5124,3-fluoro-4-methyl-phenyl boronic acid,acmc-209dxx,ksc173s0n |
| IUPAC Name | (3-fluoro-4-methylphenyl)boronic acid |
| InChI Key | WPVBHUUZDFUIJA-UHFFFAOYSA-N |
| Molecular Formula | C7H8BFO2 |