Benzene and substituted derivatives
Filtered Search Results
4-tert-Butylphenylacetylene, 90+%
CAS: 772-38-3 Molecular Formula: C12H14 Molecular Weight (g/mol): 158.244 MDL Number: MFCD00190197 InChI Key: ZSYQVVKVKBVHIL-UHFFFAOYSA-N Synonym: 1-tert-butyl-4-ethynylbenzene,4-tert-butyl phenylacetylene,4-tert-butylphenylacetylene,benzene, 1-1,1-dimethylethyl-4-ethynyl,acmc-20amtx,4-t-butylphenylacetylene,4-tert-butylphenyl ethyne,4-tert.butylphenylacetylen,4-tert-butyl phenylethyne,4-tert-butylphenyl acetylene PubChem CID: 2757302 IUPAC Name: 1-tert-butyl-4-ethynylbenzene SMILES: CC(C)(C)C1=CC=C(C=C1)C#C
| PubChem CID | 2757302 |
|---|---|
| CAS | 772-38-3 |
| Molecular Weight (g/mol) | 158.244 |
| MDL Number | MFCD00190197 |
| SMILES | CC(C)(C)C1=CC=C(C=C1)C#C |
| Synonym | 1-tert-butyl-4-ethynylbenzene,4-tert-butyl phenylacetylene,4-tert-butylphenylacetylene,benzene, 1-1,1-dimethylethyl-4-ethynyl,acmc-20amtx,4-t-butylphenylacetylene,4-tert-butylphenyl ethyne,4-tert.butylphenylacetylen,4-tert-butyl phenylethyne,4-tert-butylphenyl acetylene |
| IUPAC Name | 1-tert-butyl-4-ethynylbenzene |
| InChI Key | ZSYQVVKVKBVHIL-UHFFFAOYSA-N |
| Molecular Formula | C12H14 |
2-Fluorobenzenesulfonamide 98.0+%, TCI America™
CAS: 30058-40-3 Molecular Formula: C6H6FNO2S Molecular Weight (g/mol): 175.18 MDL Number: MFCD00042283 InChI Key: WFLBWYLZCQOPCA-UHFFFAOYSA-N Synonym: 2-fluorobenzene-1-sulfonamide,benzenesulfonamide, 2-fluoro,2-fbsa,2weg,pubchem11761,acmc-209hcr,2-fluorophenylsulfonamide,2-sulfamoyl fluorobenzene,2-fluorobenzenesulphonamide,2-flourobenzene sulfonamide PubChem CID: 193663 IUPAC Name: 2-fluorobenzene-1-sulfonamide SMILES: NS(=O)(=O)C1=CC=CC=C1F
| PubChem CID | 193663 |
|---|---|
| CAS | 30058-40-3 |
| Molecular Weight (g/mol) | 175.18 |
| MDL Number | MFCD00042283 |
| SMILES | NS(=O)(=O)C1=CC=CC=C1F |
| Synonym | 2-fluorobenzene-1-sulfonamide,benzenesulfonamide, 2-fluoro,2-fbsa,2weg,pubchem11761,acmc-209hcr,2-fluorophenylsulfonamide,2-sulfamoyl fluorobenzene,2-fluorobenzenesulphonamide,2-flourobenzene sulfonamide |
| IUPAC Name | 2-fluorobenzene-1-sulfonamide |
| InChI Key | WFLBWYLZCQOPCA-UHFFFAOYSA-N |
| Molecular Formula | C6H6FNO2S |
Bromopentamethylbenzene 97.0+%, TCI America™
CAS: 5153-40-2 Molecular Formula: C11H15Br Molecular Weight (g/mol): 227.15 MDL Number: MFCD00013523 InChI Key: XPDQRULPGCFCLX-UHFFFAOYSA-N Synonym: bromopentamethylbenzene,benzene, bromopentamethyl,pentamethylbromobenzene,1-bromopentamethylbenzene,1-bromo-2,3,4,5,6-pentamethyl-benzene,brompentamethylbenzol,maybridge1_002545,ksc273s6f,acmc-1b227,5-bromo-1,2,3,4,6-pentamethylbenzene PubChem CID: 78831 IUPAC Name: 1-bromo-2,3,4,5,6-pentamethylbenzene SMILES: CC1=C(C)C(C)=C(Br)C(C)=C1C
| PubChem CID | 78831 |
|---|---|
| CAS | 5153-40-2 |
| Molecular Weight (g/mol) | 227.15 |
| MDL Number | MFCD00013523 |
| SMILES | CC1=C(C)C(C)=C(Br)C(C)=C1C |
| Synonym | bromopentamethylbenzene,benzene, bromopentamethyl,pentamethylbromobenzene,1-bromopentamethylbenzene,1-bromo-2,3,4,5,6-pentamethyl-benzene,brompentamethylbenzol,maybridge1_002545,ksc273s6f,acmc-1b227,5-bromo-1,2,3,4,6-pentamethylbenzene |
| IUPAC Name | 1-bromo-2,3,4,5,6-pentamethylbenzene |
| InChI Key | XPDQRULPGCFCLX-UHFFFAOYSA-N |
| Molecular Formula | C11H15Br |
Pentafluoroanisole 98.0+%, TCI America™
CAS: 389-40-2 Molecular Formula: C7H3F5O Molecular Weight (g/mol): 198.092 MDL Number: MFCD00000289 InChI Key: ZRQUIRABLIQJRI-UHFFFAOYSA-N Synonym: 2,3,4,5,6-pentafluoroanisole,pentafluoroanisole,benzene, pentafluoromethoxy,pentafluorophenyl methyl ether,pentafluoromethoxybenzene,methyl pentafluorophenyl ether,benzene, 1,2,3,4,5-pentafluoro-6-methoxy,anisole, 2,3,4,5,6-pentafluoro,1,2,3,4,6-pentafluoro-5-methoxybenzene,methoxypentafluorobenzene PubChem CID: 67849 IUPAC Name: 1,2,3,4,5-pentafluoro-6-methoxybenzene SMILES: COC1=C(C(=C(C(=C1F)F)F)F)F
| PubChem CID | 67849 |
|---|---|
| CAS | 389-40-2 |
| Molecular Weight (g/mol) | 198.092 |
| MDL Number | MFCD00000289 |
| SMILES | COC1=C(C(=C(C(=C1F)F)F)F)F |
| Synonym | 2,3,4,5,6-pentafluoroanisole,pentafluoroanisole,benzene, pentafluoromethoxy,pentafluorophenyl methyl ether,pentafluoromethoxybenzene,methyl pentafluorophenyl ether,benzene, 1,2,3,4,5-pentafluoro-6-methoxy,anisole, 2,3,4,5,6-pentafluoro,1,2,3,4,6-pentafluoro-5-methoxybenzene,methoxypentafluorobenzene |
| IUPAC Name | 1,2,3,4,5-pentafluoro-6-methoxybenzene |
| InChI Key | ZRQUIRABLIQJRI-UHFFFAOYSA-N |
| Molecular Formula | C7H3F5O |
2,3-Difluoroaniline 97.0+%, TCI America™
CAS: 4519-40-8 Molecular Formula: C6H5F2N Molecular Weight (g/mol): 129.11 MDL Number: MFCD00010298 InChI Key: YCCQGFYAVUTQFK-UHFFFAOYSA-N Synonym: 2,3-difluorobenzenamine,2,3-difluorophenylamine,benzenamine, 2,3-difluoro,2,3-difluoro-phenylamine,difluoraniline,pubchem1530,acmc-1aiiw,2,3-difluorobenzenamine?,2,3-difluorophenyl amine,2,3-difluoroaniline PubChem CID: 78278 IUPAC Name: 2,3-difluoroaniline SMILES: C1=CC(=C(C(=C1)F)F)N
| PubChem CID | 78278 |
|---|---|
| CAS | 4519-40-8 |
| Molecular Weight (g/mol) | 129.11 |
| MDL Number | MFCD00010298 |
| SMILES | C1=CC(=C(C(=C1)F)F)N |
| Synonym | 2,3-difluorobenzenamine,2,3-difluorophenylamine,benzenamine, 2,3-difluoro,2,3-difluoro-phenylamine,difluoraniline,pubchem1530,acmc-1aiiw,2,3-difluorobenzenamine?,2,3-difluorophenyl amine,2,3-difluoroaniline |
| IUPAC Name | 2,3-difluoroaniline |
| InChI Key | YCCQGFYAVUTQFK-UHFFFAOYSA-N |
| Molecular Formula | C6H5F2N |
5-Bromo-2-chlorobenzyl Alcohol 98.0+%, TCI America™
CAS: 149965-40-2 Molecular Formula: C7H6BrClO Molecular Weight (g/mol): 221.48 MDL Number: MFCD02683548 InChI Key: SCHBQPIVMBDOQF-UHFFFAOYSA-N PubChem CID: 5074766 IUPAC Name: (5-bromo-2-chlorophenyl)methanol SMILES: OCC1=C(Cl)C=CC(Br)=C1
| PubChem CID | 5074766 |
|---|---|
| CAS | 149965-40-2 |
| Molecular Weight (g/mol) | 221.48 |
| MDL Number | MFCD02683548 |
| SMILES | OCC1=C(Cl)C=CC(Br)=C1 |
| IUPAC Name | (5-bromo-2-chlorophenyl)methanol |
| InChI Key | SCHBQPIVMBDOQF-UHFFFAOYSA-N |
| Molecular Formula | C7H6BrClO |
2-Ethyliodobenzene 97.0+%, TCI America™
CAS: 18282-40-1 Molecular Formula: C8H9I Molecular Weight (g/mol): 232.064 MDL Number: MFCD00040871 InChI Key: ZEJZDNMOGNUIHL-UHFFFAOYSA-N Synonym: 2-ethyliodobenzene,1-iodo-2-ethylbenzene,benzene, 1-ethyl-2-iodo,2-ethyl iodobenzene,pubchem3876,1-ethyl-2-iodo-benzene,acmc-1brg2,#,benzene,1-ethyl-2-iodo,attercop-chm at134049 PubChem CID: 140367 IUPAC Name: 1-ethyl-2-iodobenzene SMILES: CCC1=CC=CC=C1I
| PubChem CID | 140367 |
|---|---|
| CAS | 18282-40-1 |
| Molecular Weight (g/mol) | 232.064 |
| MDL Number | MFCD00040871 |
| SMILES | CCC1=CC=CC=C1I |
| Synonym | 2-ethyliodobenzene,1-iodo-2-ethylbenzene,benzene, 1-ethyl-2-iodo,2-ethyl iodobenzene,pubchem3876,1-ethyl-2-iodo-benzene,acmc-1brg2,#,benzene,1-ethyl-2-iodo,attercop-chm at134049 |
| IUPAC Name | 1-ethyl-2-iodobenzene |
| InChI Key | ZEJZDNMOGNUIHL-UHFFFAOYSA-N |
| Molecular Formula | C8H9I |
2-Chloro-3-nitrotoluene 98.0+%, TCI America™
CAS: 3970-40-9 Molecular Formula: C7H6ClNO2 Molecular Weight (g/mol): 171.58 MDL Number: MFCD00134653 InChI Key: XTSGZXRUCAWXKY-UHFFFAOYSA-N Synonym: 2-chloro-3-nitrotoluene,2-chloro-3-methylnitrobenzene,2-chloro-3-nitro toluene,benzene, 2-chloro-1-methyl-3-nitro,chloronitrotoluene,ksc493s7b,2-?chloro-?3-?nitrotoluene PubChem CID: 77591 IUPAC Name: 2-chloro-1-methyl-3-nitrobenzene SMILES: CC1=CC=CC(=C1Cl)[N+]([O-])=O
| PubChem CID | 77591 |
|---|---|
| CAS | 3970-40-9 |
| Molecular Weight (g/mol) | 171.58 |
| MDL Number | MFCD00134653 |
| SMILES | CC1=CC=CC(=C1Cl)[N+]([O-])=O |
| Synonym | 2-chloro-3-nitrotoluene,2-chloro-3-methylnitrobenzene,2-chloro-3-nitro toluene,benzene, 2-chloro-1-methyl-3-nitro,chloronitrotoluene,ksc493s7b,2-?chloro-?3-?nitrotoluene |
| IUPAC Name | 2-chloro-1-methyl-3-nitrobenzene |
| InChI Key | XTSGZXRUCAWXKY-UHFFFAOYSA-N |
| Molecular Formula | C7H6ClNO2 |
1-(2,4,6-Triisopropylbenzenesulfonyl)imidazole 98.0+%, TCI America™
CAS: 50257-40-4 Molecular Formula: C18H26N2O2S Molecular Weight (g/mol): 334.478 MDL Number: MFCD00005283 InChI Key: AGGRGODMKWLSDE-UHFFFAOYSA-N Synonym: 1-2,4,6-triisopropylphenyl sulfonyl-1h-imidazole,1-2,4,6-triisopropylbenzenesulfonyl imidazole,1-2,4,6-triisopropylphenylsulfonyl imidazole,tpsi,1-2',4',6'-triisopropylbenzenesulphonyl imidazole,1-2,4,6-tri propan-2-yl phenyl sulfonylimidazole,tpsi 1-2,4,6-triisopropylbenzenesulfonyl imidazole,1h-imidazole, 1-2,4,6-tris 1-methylethyl phenyl sulfonyl,1-2,4,6-trisopropylbenzenesulfonyl imidazole PubChem CID: 521274 IUPAC Name: 1-[2,4,6-tri(propan-2-yl)phenyl]sulfonylimidazole SMILES: CC(C)C1=CC(=C(C(=C1)C(C)C)S(=O)(=O)N2C=CN=C2)C(C)C
| PubChem CID | 521274 |
|---|---|
| CAS | 50257-40-4 |
| Molecular Weight (g/mol) | 334.478 |
| MDL Number | MFCD00005283 |
| SMILES | CC(C)C1=CC(=C(C(=C1)C(C)C)S(=O)(=O)N2C=CN=C2)C(C)C |
| Synonym | 1-2,4,6-triisopropylphenyl sulfonyl-1h-imidazole,1-2,4,6-triisopropylbenzenesulfonyl imidazole,1-2,4,6-triisopropylphenylsulfonyl imidazole,tpsi,1-2',4',6'-triisopropylbenzenesulphonyl imidazole,1-2,4,6-tri propan-2-yl phenyl sulfonylimidazole,tpsi 1-2,4,6-triisopropylbenzenesulfonyl imidazole,1h-imidazole, 1-2,4,6-tris 1-methylethyl phenyl sulfonyl,1-2,4,6-trisopropylbenzenesulfonyl imidazole |
| IUPAC Name | 1-[2,4,6-tri(propan-2-yl)phenyl]sulfonylimidazole |
| InChI Key | AGGRGODMKWLSDE-UHFFFAOYSA-N |
| Molecular Formula | C18H26N2O2S |
2,4,6-Trichloroanisole 98.0+%, TCI America™
CAS: 87-40-1 Molecular Formula: C7H5Cl3O Molecular Weight (g/mol): 211.466 MDL Number: MFCD00000588 InChI Key: WCVOGSZTONGSQY-UHFFFAOYSA-N PubChem CID: 6884 ChEBI: CHEBI:19333 IUPAC Name: 1,3,5-trichloro-2-methoxybenzene SMILES: COC1=C(C=C(C=C1Cl)Cl)Cl
| PubChem CID | 6884 |
|---|---|
| CAS | 87-40-1 |
| Molecular Weight (g/mol) | 211.466 |
| ChEBI | CHEBI:19333 |
| MDL Number | MFCD00000588 |
| SMILES | COC1=C(C=C(C=C1Cl)Cl)Cl |
| IUPAC Name | 1,3,5-trichloro-2-methoxybenzene |
| InChI Key | WCVOGSZTONGSQY-UHFFFAOYSA-N |
| Molecular Formula | C7H5Cl3O |
(2-Isopropyl-5-methylphenoxy)acetic Acid 98.0+%, TCI America™
CAS: 5333-40-4 Molecular Formula: C12H16O3 Molecular Weight (g/mol): 208.257 MDL Number: MFCD00021757 InChI Key: MURZAHIYMVFXCF-UHFFFAOYSA-N PubChem CID: 220116 IUPAC Name: 2-(5-methyl-2-propan-2-ylphenoxy)acetic acid SMILES: CC1=CC(=C(C=C1)C(C)C)OCC(=O)O
| PubChem CID | 220116 |
|---|---|
| CAS | 5333-40-4 |
| Molecular Weight (g/mol) | 208.257 |
| MDL Number | MFCD00021757 |
| SMILES | CC1=CC(=C(C=C1)C(C)C)OCC(=O)O |
| IUPAC Name | 2-(5-methyl-2-propan-2-ylphenoxy)acetic acid |
| InChI Key | MURZAHIYMVFXCF-UHFFFAOYSA-N |
| Molecular Formula | C12H16O3 |
2,2-Bis(4-hydroxyphenyl)butane 98.0+%, TCI America™
CAS: 77-40-7 Molecular Formula: C16H18O2 Molecular Weight (g/mol): 242.32 MDL Number: MFCD00020179 InChI Key: HTVITOHKHWFJKO-UHFFFAOYSA-N Synonym: bisphenol b,2,2-bis 4-hydroxyphenyl butane,4,4'-butane-2,2-diyl diphenol,phenol, 4,4'-1-methylpropylidene bis,p,p'-sec-butylidenediphenol,unii-1rc731tjja,4,4'-1-methylpropylidene bisphenol,1rc731tjja,4,4'-sec-butylidenediphenol,2,2-bis p-hydroxyphenyl butane PubChem CID: 66166 ChEBI: CHEBI:34581 IUPAC Name: 4-[2-(4-hydroxyphenyl)butan-2-yl]phenol SMILES: CCC(C)(C1=CC=C(O)C=C1)C1=CC=C(O)C=C1
| PubChem CID | 66166 |
|---|---|
| CAS | 77-40-7 |
| Molecular Weight (g/mol) | 242.32 |
| ChEBI | CHEBI:34581 |
| MDL Number | MFCD00020179 |
| SMILES | CCC(C)(C1=CC=C(O)C=C1)C1=CC=C(O)C=C1 |
| Synonym | bisphenol b,2,2-bis 4-hydroxyphenyl butane,4,4'-butane-2,2-diyl diphenol,phenol, 4,4'-1-methylpropylidene bis,p,p'-sec-butylidenediphenol,unii-1rc731tjja,4,4'-1-methylpropylidene bisphenol,1rc731tjja,4,4'-sec-butylidenediphenol,2,2-bis p-hydroxyphenyl butane |
| IUPAC Name | 4-[2-(4-hydroxyphenyl)butan-2-yl]phenol |
| InChI Key | HTVITOHKHWFJKO-UHFFFAOYSA-N |
| Molecular Formula | C16H18O2 |
1-Chloro-2-methyl-2-phenylpropane 98.0+%, TCI America™
CAS: 515-40-2 Molecular Formula: C10H13Cl Molecular Weight (g/mol): 168.66 MDL Number: MFCD00000940 InChI Key: DNXXUUPUQXSUFH-UHFFFAOYSA-N Synonym: neophyl chloride,1-chloro-2-methyl-2-phenylpropane,1-chloro-2-methylpropan-2-yl benzene,benzene, 2-chloro-1,1-dimethylethyl,2-methyl-2-phenylpropyl chloride,neophylchloride,2-chloro-1,1-dimethylethyl benzene,unii-of6e0410nf,beta-chloro-tert-butylbenzene,2-chloromethyl-2-phenylpropane PubChem CID: 68191 IUPAC Name: (1-chloro-2-methylpropan-2-yl)benzene SMILES: CC(C)(CCl)C1=CC=CC=C1
| PubChem CID | 68191 |
|---|---|
| CAS | 515-40-2 |
| Molecular Weight (g/mol) | 168.66 |
| MDL Number | MFCD00000940 |
| SMILES | CC(C)(CCl)C1=CC=CC=C1 |
| Synonym | neophyl chloride,1-chloro-2-methyl-2-phenylpropane,1-chloro-2-methylpropan-2-yl benzene,benzene, 2-chloro-1,1-dimethylethyl,2-methyl-2-phenylpropyl chloride,neophylchloride,2-chloro-1,1-dimethylethyl benzene,unii-of6e0410nf,beta-chloro-tert-butylbenzene,2-chloromethyl-2-phenylpropane |
| IUPAC Name | (1-chloro-2-methylpropan-2-yl)benzene |
| InChI Key | DNXXUUPUQXSUFH-UHFFFAOYSA-N |
| Molecular Formula | C10H13Cl |
4,5-Difluoro-1,2-phenylenediamine 97.0+%, TCI America™
CAS: 76179-40-3 Molecular Formula: C6H6F2N2 Molecular Weight (g/mol): 144.13 MDL Number: MFCD00061131 InChI Key: PPWRHKISAQTCCG-UHFFFAOYSA-N Synonym: 1,2-diamino-4,5-difluorobenzene,4,5-difluoro-1,2-phenylenediamine,4,5-difluoro-o-phenylenediamine,2-amino-4,5-difluorophenylamine,4,5-difluoro-benzene-1,2-diamine,4,5-difluoro-1,2-benzenediamine,1,2-benzenediamine,4,5-difluoro,1,2-benzenediamine, 4,5-difluoro,pubchem4354,2-amino-4,5-difluoroaniline PubChem CID: 2736755 IUPAC Name: 4,5-difluorobenzene-1,2-diamine SMILES: NC1=CC(F)=C(F)C=C1N
| PubChem CID | 2736755 |
|---|---|
| CAS | 76179-40-3 |
| Molecular Weight (g/mol) | 144.13 |
| MDL Number | MFCD00061131 |
| SMILES | NC1=CC(F)=C(F)C=C1N |
| Synonym | 1,2-diamino-4,5-difluorobenzene,4,5-difluoro-1,2-phenylenediamine,4,5-difluoro-o-phenylenediamine,2-amino-4,5-difluorophenylamine,4,5-difluoro-benzene-1,2-diamine,4,5-difluoro-1,2-benzenediamine,1,2-benzenediamine,4,5-difluoro,1,2-benzenediamine, 4,5-difluoro,pubchem4354,2-amino-4,5-difluoroaniline |
| IUPAC Name | 4,5-difluorobenzene-1,2-diamine |
| InChI Key | PPWRHKISAQTCCG-UHFFFAOYSA-N |
| Molecular Formula | C6H6F2N2 |
2,2'-Bis(hydroxymethyl)diphenyl Ether 98.0+%, TCI America™
CAS: 10038-40-1 Molecular Formula: C14H14O3 Molecular Weight (g/mol): 230.263 MDL Number: MFCD00191613 InChI Key: VRVKKKKXKVCPEW-UHFFFAOYSA-N PubChem CID: 611393 IUPAC Name: [2-[2-(hydroxymethyl)phenoxy]phenyl]methanol SMILES: C1=CC=C(C(=C1)CO)OC2=CC=CC=C2CO
| PubChem CID | 611393 |
|---|---|
| CAS | 10038-40-1 |
| Molecular Weight (g/mol) | 230.263 |
| MDL Number | MFCD00191613 |
| SMILES | C1=CC=C(C(=C1)CO)OC2=CC=CC=C2CO |
| IUPAC Name | [2-[2-(hydroxymethyl)phenoxy]phenyl]methanol |
| InChI Key | VRVKKKKXKVCPEW-UHFFFAOYSA-N |
| Molecular Formula | C14H14O3 |