Benzene and substituted derivatives
Filtered Search Results
5-Bromo-2-hydroxybenzyl Alcohol 98.0+%, TCI America™
CAS: 2316-64-5 Molecular Formula: C7H7BrO2 Molecular Weight (g/mol): 203.04 MDL Number: MFCD00004618 InChI Key: KNKRHSVKIORZQB-UHFFFAOYSA-N Synonym: 5-bromo-2-hydroxybenzyl alcohol,4-bromo-2-hydroxymethyl phenol,bromosaligenin,5-bromosalicyl alcohol,bromsalizol,5-bromosaligenin,5-bromo-2-hydroxybenzylalcohol,2-hydroxymethyl-4-bromophenol,benzenemethanol, 5-bromo-2-hydroxy,unii-y1uz53815e PubChem CID: 75342 IUPAC Name: 4-bromo-2-(hydroxymethyl)phenol SMILES: OCC1=CC(Br)=CC=C1O
| PubChem CID | 75342 |
|---|---|
| CAS | 2316-64-5 |
| Molecular Weight (g/mol) | 203.04 |
| MDL Number | MFCD00004618 |
| SMILES | OCC1=CC(Br)=CC=C1O |
| Synonym | 5-bromo-2-hydroxybenzyl alcohol,4-bromo-2-hydroxymethyl phenol,bromosaligenin,5-bromosalicyl alcohol,bromsalizol,5-bromosaligenin,5-bromo-2-hydroxybenzylalcohol,2-hydroxymethyl-4-bromophenol,benzenemethanol, 5-bromo-2-hydroxy,unii-y1uz53815e |
| IUPAC Name | 4-bromo-2-(hydroxymethyl)phenol |
| InChI Key | KNKRHSVKIORZQB-UHFFFAOYSA-N |
| Molecular Formula | C7H7BrO2 |
Amyl Benzoate 98.0+%, TCI America™
CAS: 2049-96-9 Molecular Formula: C12H16O2 Molecular Weight (g/mol): 192.258 MDL Number: MFCD00048843 InChI Key: QKNZNUNCDJZTCH-UHFFFAOYSA-N Synonym: amyl benzoate,n-pentyl benzoate,benzoic acid, pentyl ester,n-amyl benzoate,unii-cle7k4b29s,cle7k4b29s,amylbenzoat,amylbenzoate,n amyl benxoate,benzoic acid pentyl PubChem CID: 16296 IUPAC Name: pentyl benzoate SMILES: CCCCCOC(=O)C1=CC=CC=C1
| PubChem CID | 16296 |
|---|---|
| CAS | 2049-96-9 |
| Molecular Weight (g/mol) | 192.258 |
| MDL Number | MFCD00048843 |
| SMILES | CCCCCOC(=O)C1=CC=CC=C1 |
| Synonym | amyl benzoate,n-pentyl benzoate,benzoic acid, pentyl ester,n-amyl benzoate,unii-cle7k4b29s,cle7k4b29s,amylbenzoat,amylbenzoate,n amyl benxoate,benzoic acid pentyl |
| IUPAC Name | pentyl benzoate |
| InChI Key | QKNZNUNCDJZTCH-UHFFFAOYSA-N |
| Molecular Formula | C12H16O2 |
Ethyl 2-Ethoxybenzoate 98.0+%, TCI America™
CAS: 6290-24-0 Molecular Formula: C11H14O3 Molecular Weight (g/mol): 194.23 MDL Number: MFCD00142907 InChI Key: OUZCDRGUTZLAGO-UHFFFAOYSA-N Synonym: 2-Ethoxybenzoic Acid Ethyl Ester PubChem CID: 221644 IUPAC Name: ethyl 2-ethoxybenzoate SMILES: CCOC1=CC=CC=C1C(=O)OCC
| PubChem CID | 221644 |
|---|---|
| CAS | 6290-24-0 |
| Molecular Weight (g/mol) | 194.23 |
| MDL Number | MFCD00142907 |
| SMILES | CCOC1=CC=CC=C1C(=O)OCC |
| Synonym | 2-Ethoxybenzoic Acid Ethyl Ester |
| IUPAC Name | ethyl 2-ethoxybenzoate |
| InChI Key | OUZCDRGUTZLAGO-UHFFFAOYSA-N |
| Molecular Formula | C11H14O3 |
(S)-O-Desmethylraclopride 98.0+%, TCI America™
CAS: 119670-11-0 Molecular Formula: C14H18Cl2N2O3 Molecular Weight (g/mol): 333.209 MDL Number: MFCD02179385 InChI Key: DPQOMEPZWBXAMA-QMMMGPOBSA-N Synonym: (S)-3,5-Dichloro-N-[(1-ethyl-2-pyrrolidinyl)methyl]-2,6-dihydroxybenzamide PubChem CID: 10947574 IUPAC Name: 3,5-dichloro-N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-2,6-dihydroxybenzamide SMILES: CCN1CCCC1CNC(=O)C2=C(C(=CC(=C2O)Cl)Cl)O
| PubChem CID | 10947574 |
|---|---|
| CAS | 119670-11-0 |
| Molecular Weight (g/mol) | 333.209 |
| MDL Number | MFCD02179385 |
| SMILES | CCN1CCCC1CNC(=O)C2=C(C(=CC(=C2O)Cl)Cl)O |
| Synonym | (S)-3,5-Dichloro-N-[(1-ethyl-2-pyrrolidinyl)methyl]-2,6-dihydroxybenzamide |
| IUPAC Name | 3,5-dichloro-N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-2,6-dihydroxybenzamide |
| InChI Key | DPQOMEPZWBXAMA-QMMMGPOBSA-N |
| Molecular Formula | C14H18Cl2N2O3 |
4,4'-Dibutoxybiphenyl 98.0+%, TCI America™
CAS: 39800-63-0 Molecular Formula: C20H26O2 Molecular Weight (g/mol): 298.426 MDL Number: MFCD00059419 InChI Key: IBCVAKLNEYUUBM-UHFFFAOYSA-N PubChem CID: 604312 IUPAC Name: 1-butoxy-4-(4-butoxyphenyl)benzene SMILES: CCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)OCCCC
| PubChem CID | 604312 |
|---|---|
| CAS | 39800-63-0 |
| Molecular Weight (g/mol) | 298.426 |
| MDL Number | MFCD00059419 |
| SMILES | CCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)OCCCC |
| IUPAC Name | 1-butoxy-4-(4-butoxyphenyl)benzene |
| InChI Key | IBCVAKLNEYUUBM-UHFFFAOYSA-N |
| Molecular Formula | C20H26O2 |
Ethyl 3,5-Dichloro-4-hydroxybenzoate 98.0+%, TCI America™
CAS: 17302-82-8 Molecular Formula: C9H8Cl2O3 Molecular Weight (g/mol): 235.06 MDL Number: MFCD00016420 InChI Key: WMKNGSJJEMFQOT-UHFFFAOYSA-N Synonym: 3,5-dichloro-4-hydroxybenzoic acid ethyl ester,benzoic acid, 3,5-dichloro-4-hydroxy-, ethyl ester,3,5-dichloro-4-hydroxy-benzoic acid ethyl ester,acmc-209e5q,3-10-00-00363 beilstein handbook reference,wln: qr bg fg dvo2,ethyl 3,5-dichloro-4-hydroxy-benzoate,ethyl 3,5-bis chloranyl-4-oxidanyl-benzoate,benzoic acid,5-dichloro-4-hydroxy-, ethyl ester PubChem CID: 28460 IUPAC Name: ethyl 3,5-dichloro-4-hydroxybenzoate SMILES: CCOC(=O)C1=CC(=C(C(=C1)Cl)O)Cl
| PubChem CID | 28460 |
|---|---|
| CAS | 17302-82-8 |
| Molecular Weight (g/mol) | 235.06 |
| MDL Number | MFCD00016420 |
| SMILES | CCOC(=O)C1=CC(=C(C(=C1)Cl)O)Cl |
| Synonym | 3,5-dichloro-4-hydroxybenzoic acid ethyl ester,benzoic acid, 3,5-dichloro-4-hydroxy-, ethyl ester,3,5-dichloro-4-hydroxy-benzoic acid ethyl ester,acmc-209e5q,3-10-00-00363 beilstein handbook reference,wln: qr bg fg dvo2,ethyl 3,5-dichloro-4-hydroxy-benzoate,ethyl 3,5-bis chloranyl-4-oxidanyl-benzoate,benzoic acid,5-dichloro-4-hydroxy-, ethyl ester |
| IUPAC Name | ethyl 3,5-dichloro-4-hydroxybenzoate |
| InChI Key | WMKNGSJJEMFQOT-UHFFFAOYSA-N |
| Molecular Formula | C9H8Cl2O3 |
2-Fluoro-5-methoxybenzonitrile 98.0+%, TCI America™
CAS: 127667-01-0 Molecular Formula: C8H6FNO Molecular Weight (g/mol): 151.14 MDL Number: MFCD00142921 InChI Key: VBZLRHYLNXWZIU-UHFFFAOYSA-N Synonym: 2-fluoro-5-methoxy-benzonitrile,benzonitrile, 2-fluoro-5-methoxy,3-cyano-4-fluoroanisole,fluoromethoxybenzonitrile2,2-fluoro-5-methoxybenzenecarbonitrile,pubchem3500,acmc-209bct,ksc494m9f,2-fluoro-5-methoxy benzonitrile,buttpark 80\01-21 PubChem CID: 2774546 IUPAC Name: 2-fluoro-5-methoxybenzonitrile SMILES: COC1=CC(C#N)=C(F)C=C1
| PubChem CID | 2774546 |
|---|---|
| CAS | 127667-01-0 |
| Molecular Weight (g/mol) | 151.14 |
| MDL Number | MFCD00142921 |
| SMILES | COC1=CC(C#N)=C(F)C=C1 |
| Synonym | 2-fluoro-5-methoxy-benzonitrile,benzonitrile, 2-fluoro-5-methoxy,3-cyano-4-fluoroanisole,fluoromethoxybenzonitrile2,2-fluoro-5-methoxybenzenecarbonitrile,pubchem3500,acmc-209bct,ksc494m9f,2-fluoro-5-methoxy benzonitrile,buttpark 80\01-21 |
| IUPAC Name | 2-fluoro-5-methoxybenzonitrile |
| InChI Key | VBZLRHYLNXWZIU-UHFFFAOYSA-N |
| Molecular Formula | C8H6FNO |
3-Fluorobenzylamine 98.0+%, TCI America™
CAS: 100-82-3 Molecular Formula: C7H8FN Molecular Weight (g/mol): 125.146 InChI Key: QVSVMNXRLWSNGS-UHFFFAOYSA-N Synonym: 3-fluorobenzylamine,3-fluorophenyl methanamine,m-fluorobenzylamine,benzenemethanamine, 3-fluoro,1-3-fluorophenyl methanamine,3-fluoro-benzylamine,benzylamine, m-fluoro,3-fluorophenyl methylamine,m-fluorobenzyl amine,3-fluorobenzyl amine PubChem CID: 66853 IUPAC Name: (3-fluorophenyl)methanamine SMILES: C1=CC(=CC(=C1)F)CN
| PubChem CID | 66853 |
|---|---|
| CAS | 100-82-3 |
| Molecular Weight (g/mol) | 125.146 |
| SMILES | C1=CC(=CC(=C1)F)CN |
| Synonym | 3-fluorobenzylamine,3-fluorophenyl methanamine,m-fluorobenzylamine,benzenemethanamine, 3-fluoro,1-3-fluorophenyl methanamine,3-fluoro-benzylamine,benzylamine, m-fluoro,3-fluorophenyl methylamine,m-fluorobenzyl amine,3-fluorobenzyl amine |
| IUPAC Name | (3-fluorophenyl)methanamine |
| InChI Key | QVSVMNXRLWSNGS-UHFFFAOYSA-N |
| Molecular Formula | C7H8FN |
3,4,5-Trimethoxybenzaldehyde 98.0+%, TCI America™
CAS: 86-81-7 Molecular Formula: C10H12O4 Molecular Weight (g/mol): 196.202 MDL Number: MFCD00003364 InChI Key: OPHQOIGEOHXOGX-UHFFFAOYSA-N PubChem CID: 6858 IUPAC Name: 3,4,5-trimethoxybenzaldehyde SMILES: COC1=CC(=CC(=C1OC)OC)C=O
| PubChem CID | 6858 |
|---|---|
| CAS | 86-81-7 |
| Molecular Weight (g/mol) | 196.202 |
| MDL Number | MFCD00003364 |
| SMILES | COC1=CC(=CC(=C1OC)OC)C=O |
| IUPAC Name | 3,4,5-trimethoxybenzaldehyde |
| InChI Key | OPHQOIGEOHXOGX-UHFFFAOYSA-N |
| Molecular Formula | C10H12O4 |
2-(2-Bromophenyl)-2,3-dihydro-1H-naphtho[1,8-de][1,3,2]diazaborine 98.0+%, TCI America™
CAS: 927384-42-7 Molecular Formula: C16H12BBrN2 Molecular Weight (g/mol): 323.00 MDL Number: MFCD16038144 InChI Key: VHWWJBPYVUEFBM-UHFFFAOYSA-N Synonym: 2-Bromo-1-(2,3-dihydro-1H-naphtho[1,8-de]-1,3,2-diazaborinyl)benzene, 2-(2-Bromophenyl)-2,3-dihydro-1H-naphtho[1,8-de][1,3,2]diazaborinine PubChem CID: 53384411 IUPAC Name: 3-(2-bromophenyl)-2,4-diaza-3-boratricyclo[7.3.1.0⁵,¹³]trideca-1(13),5,7,9,11-pentaene SMILES: BrC1=CC=CC=C1B1NC2=CC=CC3=CC=CC(N1)=C23
| PubChem CID | 53384411 |
|---|---|
| CAS | 927384-42-7 |
| Molecular Weight (g/mol) | 323.00 |
| MDL Number | MFCD16038144 |
| SMILES | BrC1=CC=CC=C1B1NC2=CC=CC3=CC=CC(N1)=C23 |
| Synonym | 2-Bromo-1-(2,3-dihydro-1H-naphtho[1,8-de]-1,3,2-diazaborinyl)benzene, 2-(2-Bromophenyl)-2,3-dihydro-1H-naphtho[1,8-de][1,3,2]diazaborinine |
| IUPAC Name | 3-(2-bromophenyl)-2,4-diaza-3-boratricyclo[7.3.1.0⁵,¹³]trideca-1(13),5,7,9,11-pentaene |
| InChI Key | VHWWJBPYVUEFBM-UHFFFAOYSA-N |
| Molecular Formula | C16H12BBrN2 |
2,4-Difluorophenyl Isocyanate 98.0+%, TCI America™
CAS: 59025-55-7 Molecular Formula: C7H3F2NO Molecular Weight (g/mol): 155.10 MDL Number: MFCD00001997 InChI Key: HNENEALJPWJWJY-UHFFFAOYSA-N Synonym: 2,4-difluorophenyl isocyanate,2,4-difluorophenylisocyanate,benzene, 2,4-difluoro-1-isocyanato,isocyanic acid 2,4-difluorophenyl ester,2,4-difluoro-1-isocyanato-benzene,2,4-difluoroisocyanatobenzene,timtec-bb sbb006537,pubchem4453,2,4-diflurophenylisocyanate,acmc-1b06k PubChem CID: 593258 IUPAC Name: 2,4-difluoro-1-isocyanatobenzene SMILES: FC1=CC=C(N=C=O)C(F)=C1
| PubChem CID | 593258 |
|---|---|
| CAS | 59025-55-7 |
| Molecular Weight (g/mol) | 155.10 |
| MDL Number | MFCD00001997 |
| SMILES | FC1=CC=C(N=C=O)C(F)=C1 |
| Synonym | 2,4-difluorophenyl isocyanate,2,4-difluorophenylisocyanate,benzene, 2,4-difluoro-1-isocyanato,isocyanic acid 2,4-difluorophenyl ester,2,4-difluoro-1-isocyanato-benzene,2,4-difluoroisocyanatobenzene,timtec-bb sbb006537,pubchem4453,2,4-diflurophenylisocyanate,acmc-1b06k |
| IUPAC Name | 2,4-difluoro-1-isocyanatobenzene |
| InChI Key | HNENEALJPWJWJY-UHFFFAOYSA-N |
| Molecular Formula | C7H3F2NO |
3,5-Dimethoxytoluene 97.0+%, TCI America™
CAS: 4179-19-5 Molecular Formula: C9H12O2 Molecular Weight (g/mol): 152.19 MDL Number: MFCD00015435 InChI Key: RIZBLVRXRWHLFA-UHFFFAOYSA-N Synonym: 3,5-dimethoxytoluene,orcinol dimethyl ether,benzene, 1,3-dimethoxy-5-methyl,5-methylresorcinol dimethyl ether,3,5-dimethoxy toluene,toluene, 3,5-dimethoxy,1,3-dimethoxy-5-methyl-benzene,pubchem17775,acmc-1ak5i PubChem CID: 77844 IUPAC Name: 1,3-dimethoxy-5-methylbenzene SMILES: COC1=CC(OC)=CC(C)=C1
| PubChem CID | 77844 |
|---|---|
| CAS | 4179-19-5 |
| Molecular Weight (g/mol) | 152.19 |
| MDL Number | MFCD00015435 |
| SMILES | COC1=CC(OC)=CC(C)=C1 |
| Synonym | 3,5-dimethoxytoluene,orcinol dimethyl ether,benzene, 1,3-dimethoxy-5-methyl,5-methylresorcinol dimethyl ether,3,5-dimethoxy toluene,toluene, 3,5-dimethoxy,1,3-dimethoxy-5-methyl-benzene,pubchem17775,acmc-1ak5i |
| IUPAC Name | 1,3-dimethoxy-5-methylbenzene |
| InChI Key | RIZBLVRXRWHLFA-UHFFFAOYSA-N |
| Molecular Formula | C9H12O2 |
1-Benzyl-3-(ethylamino)pyrrolidine 96.0+%, TCI America™
CAS: 115445-21-1 Molecular Formula: C13H20N2 Molecular Weight (g/mol): 204.317 MDL Number: MFCD00191305 InChI Key: ZSIUSRJKSLXIJH-UHFFFAOYSA-N PubChem CID: 10330560 IUPAC Name: 1-benzyl-N-ethylpyrrolidin-3-amine SMILES: CCNC1CCN(C1)CC2=CC=CC=C2
| PubChem CID | 10330560 |
|---|---|
| CAS | 115445-21-1 |
| Molecular Weight (g/mol) | 204.317 |
| MDL Number | MFCD00191305 |
| SMILES | CCNC1CCN(C1)CC2=CC=CC=C2 |
| IUPAC Name | 1-benzyl-N-ethylpyrrolidin-3-amine |
| InChI Key | ZSIUSRJKSLXIJH-UHFFFAOYSA-N |
| Molecular Formula | C13H20N2 |
3-Fluoro-5-(trifluoromethyl)benzoic Acid 98.0+%, TCI America™
CAS: 161622-05-5 Molecular Formula: C8H3F4O2 Molecular Weight (g/mol): 207.10 MDL Number: MFCD00061293 InChI Key: NSGKIIGVPBTOBF-UHFFFAOYSA-M Synonym: 3-fluoro-5-trifluoromethyl benzoic acid,alpha,alpha,alpha,5-tetrafluoro-m-toluic acid,benzoic acid, 3-fluoro-5-trifluoromethyl,5-fluoro-3-trifluoromethyl benzoic acid,maybridge4_001933,acmc-1bwlq,intermediates-zcf02214,ksc496a7r,rarechem al bo 0634,buttpark 32\01-71 PubChem CID: 519222 IUPAC Name: 3-fluoro-5-(trifluoromethyl)benzoate SMILES: [O-]C(=O)C1=CC(F)=CC(=C1)C(F)(F)F
| PubChem CID | 519222 |
|---|---|
| CAS | 161622-05-5 |
| Molecular Weight (g/mol) | 207.10 |
| MDL Number | MFCD00061293 |
| SMILES | [O-]C(=O)C1=CC(F)=CC(=C1)C(F)(F)F |
| Synonym | 3-fluoro-5-trifluoromethyl benzoic acid,alpha,alpha,alpha,5-tetrafluoro-m-toluic acid,benzoic acid, 3-fluoro-5-trifluoromethyl,5-fluoro-3-trifluoromethyl benzoic acid,maybridge4_001933,acmc-1bwlq,intermediates-zcf02214,ksc496a7r,rarechem al bo 0634,buttpark 32\01-71 |
| IUPAC Name | 3-fluoro-5-(trifluoromethyl)benzoate |
| InChI Key | NSGKIIGVPBTOBF-UHFFFAOYSA-M |
| Molecular Formula | C8H3F4O2 |