Benzene and substituted derivatives
Filtered Search Results
Methyl 5-(Ethylsulfonyl)-2-methoxybenzoate 98.0+%, TCI America™
CAS: 62140-67-4 Molecular Formula: C11H14O5S Molecular Weight (g/mol): 258.288 MDL Number: MFCD01317547 InChI Key: UUARTHQJSZTOEM-UHFFFAOYSA-N Synonym: 5-(Ethylsulfonyl)-2-methoxybenzoic Acid Methyl Ester PubChem CID: 6454351 IUPAC Name: methyl 5-ethylsulfonyl-2-methoxybenzoate SMILES: CCS(=O)(=O)C1=CC(=C(C=C1)OC)C(=O)OC
| PubChem CID | 6454351 |
|---|---|
| CAS | 62140-67-4 |
| Molecular Weight (g/mol) | 258.288 |
| MDL Number | MFCD01317547 |
| SMILES | CCS(=O)(=O)C1=CC(=C(C=C1)OC)C(=O)OC |
| Synonym | 5-(Ethylsulfonyl)-2-methoxybenzoic Acid Methyl Ester |
| IUPAC Name | methyl 5-ethylsulfonyl-2-methoxybenzoate |
| InChI Key | UUARTHQJSZTOEM-UHFFFAOYSA-N |
| Molecular Formula | C11H14O5S |
1,3,5-Tris(3,5-dibromophenyl)benzene 95.0+%, TCI America™
CAS: 29102-67-8 Molecular Formula: C24H12Br6 Molecular Weight (g/mol): 779.78 MDL Number: MFCD13193235 InChI Key: VBMGLVNBADCRDN-UHFFFAOYSA-N PubChem CID: 591077 IUPAC Name: 3,5-dibromo-3',5'-bis(3,5-dibromophenyl)-1,1'-biphenyl SMILES: BrC1=CC(=CC(Br)=C1)C1=CC(=CC(=C1)C1=CC(Br)=CC(Br)=C1)C1=CC(Br)=CC(Br)=C1
| PubChem CID | 591077 |
|---|---|
| CAS | 29102-67-8 |
| Molecular Weight (g/mol) | 779.78 |
| MDL Number | MFCD13193235 |
| SMILES | BrC1=CC(=CC(Br)=C1)C1=CC(=CC(=C1)C1=CC(Br)=CC(Br)=C1)C1=CC(Br)=CC(Br)=C1 |
| IUPAC Name | 3,5-dibromo-3',5'-bis(3,5-dibromophenyl)-1,1'-biphenyl |
| InChI Key | VBMGLVNBADCRDN-UHFFFAOYSA-N |
| Molecular Formula | C24H12Br6 |
3,4-Dihydroxybenzophenone 98.0+%, TCI America™
CAS: 10425-11-3 Molecular Formula: C13H10O3 Molecular Weight (g/mol): 214.22 MDL Number: MFCD00477203 InChI Key: ARWCZKJISXFBGI-UHFFFAOYSA-N Synonym: 3,4-dihydroxybenzophenone,3,4-dihydroxyphenyl phenyl methanone,3,4-dihydroxyphenyl phenylmethanone,methanone, 3,4-dihydroxyphenyl phenyl,3,4-dihydroxy-diphenyl ketone,3,4-dihydroxyphenyl-phenylmethanone,4-benzoylbenzene-1,2-diol,3,4-dihydroxyphenyl phenyl ketone,4-benzoylpyrocatechol,pubchem3385 PubChem CID: 165870 IUPAC Name: (3,4-dihydroxyphenyl)-phenylmethanone SMILES: C1=CC=C(C=C1)C(=O)C2=CC(=C(C=C2)O)O
| PubChem CID | 165870 |
|---|---|
| CAS | 10425-11-3 |
| Molecular Weight (g/mol) | 214.22 |
| MDL Number | MFCD00477203 |
| SMILES | C1=CC=C(C=C1)C(=O)C2=CC(=C(C=C2)O)O |
| Synonym | 3,4-dihydroxybenzophenone,3,4-dihydroxyphenyl phenyl methanone,3,4-dihydroxyphenyl phenylmethanone,methanone, 3,4-dihydroxyphenyl phenyl,3,4-dihydroxy-diphenyl ketone,3,4-dihydroxyphenyl-phenylmethanone,4-benzoylbenzene-1,2-diol,3,4-dihydroxyphenyl phenyl ketone,4-benzoylpyrocatechol,pubchem3385 |
| IUPAC Name | (3,4-dihydroxyphenyl)-phenylmethanone |
| InChI Key | ARWCZKJISXFBGI-UHFFFAOYSA-N |
| Molecular Formula | C13H10O3 |
1-Bromo-4-(trifluoromethoxy)benzene 98.0+%, TCI America™
CAS: 407-14-7 Molecular Formula: C7H4BrF3O Molecular Weight (g/mol): 241.01 MDL Number: MFCD00040834 InChI Key: SEAOBYFQWJFORM-UHFFFAOYSA-N Synonym: 1-bromo-4-trifluoromethoxy benzene,4-trifluoromethoxy bromobenzene,4-bromo trifluoromethoxy benzene,4-trifluoromethoxybromobenzene,p-bromotrifluoromethoxybenzene,benzene, 1-bromo-4-trifluoromethoxy,4-bromo-1-trifluoromethoxy benzene,p-trifluoromethoxybromobenzene,4-bromotrifluoromethoxybenzene,4-bromo-trifluoromethoxybenzene PubChem CID: 521008 IUPAC Name: 1-bromo-4-(trifluoromethoxy)benzene SMILES: FC(F)(F)OC1=CC=C(Br)C=C1
| PubChem CID | 521008 |
|---|---|
| CAS | 407-14-7 |
| Molecular Weight (g/mol) | 241.01 |
| MDL Number | MFCD00040834 |
| SMILES | FC(F)(F)OC1=CC=C(Br)C=C1 |
| Synonym | 1-bromo-4-trifluoromethoxy benzene,4-trifluoromethoxy bromobenzene,4-bromo trifluoromethoxy benzene,4-trifluoromethoxybromobenzene,p-bromotrifluoromethoxybenzene,benzene, 1-bromo-4-trifluoromethoxy,4-bromo-1-trifluoromethoxy benzene,p-trifluoromethoxybromobenzene,4-bromotrifluoromethoxybenzene,4-bromo-trifluoromethoxybenzene |
| IUPAC Name | 1-bromo-4-(trifluoromethoxy)benzene |
| InChI Key | SEAOBYFQWJFORM-UHFFFAOYSA-N |
| Molecular Formula | C7H4BrF3O |
1-Bromo-2-ethynylbenzene 98.0+%, TCI America™
CAS: 766-46-1 Molecular Formula: C8H5Br Molecular Weight (g/mol): 181.032 MDL Number: MFCD01863358 InChI Key: RVDOYUFNRDGYGU-UHFFFAOYSA-N Synonym: 2-Bromophenylacetylene PubChem CID: 602067 IUPAC Name: 1-bromo-2-ethynylbenzene SMILES: C#CC1=CC=CC=C1Br
| PubChem CID | 602067 |
|---|---|
| CAS | 766-46-1 |
| Molecular Weight (g/mol) | 181.032 |
| MDL Number | MFCD01863358 |
| SMILES | C#CC1=CC=CC=C1Br |
| Synonym | 2-Bromophenylacetylene |
| IUPAC Name | 1-bromo-2-ethynylbenzene |
| InChI Key | RVDOYUFNRDGYGU-UHFFFAOYSA-N |
| Molecular Formula | C8H5Br |
1-Nitro-4-(trifluoromethoxy)benzene 96.0+%, TCI America™
CAS: 713-65-5 Molecular Formula: C7H4F3NO3 Molecular Weight (g/mol): 207.11 MDL Number: MFCD00040302 InChI Key: UBEIKVUMDBCCRW-UHFFFAOYSA-N Synonym: 1-nitro-4-trifluoromethoxy benzene,4-trifluoromethoxy nitrobenzene,p-nitrotrifluoromethoxybenzene,4-nitro-1-trifluoromethoxybenzene,1-nitro-4-trifluoromethoxy-benzene,p-nitrotrifluoromethoxybenzen,benzene, 1-nitro-4-trifluoromethoxy,alpha,alpha,alpha-trifluoro-4'-nitroanisole,p-nitrotrifluoroanisole PubChem CID: 522405 IUPAC Name: 1-nitro-4-(trifluoromethoxy)benzene SMILES: [O-][N+](=O)C1=CC=C(OC(F)(F)F)C=C1
| PubChem CID | 522405 |
|---|---|
| CAS | 713-65-5 |
| Molecular Weight (g/mol) | 207.11 |
| MDL Number | MFCD00040302 |
| SMILES | [O-][N+](=O)C1=CC=C(OC(F)(F)F)C=C1 |
| Synonym | 1-nitro-4-trifluoromethoxy benzene,4-trifluoromethoxy nitrobenzene,p-nitrotrifluoromethoxybenzene,4-nitro-1-trifluoromethoxybenzene,1-nitro-4-trifluoromethoxy-benzene,p-nitrotrifluoromethoxybenzen,benzene, 1-nitro-4-trifluoromethoxy,alpha,alpha,alpha-trifluoro-4'-nitroanisole,p-nitrotrifluoroanisole |
| IUPAC Name | 1-nitro-4-(trifluoromethoxy)benzene |
| InChI Key | UBEIKVUMDBCCRW-UHFFFAOYSA-N |
| Molecular Formula | C7H4F3NO3 |
Tris(triphenylphosphine)rhodium(I) Chloride 98.0+%, TCI America™
CAS: 14694-95-2 Molecular Formula: C54H45ClP3Rh Molecular Weight (g/mol): 925.23 MDL Number: MFCD00010016 InChI Key: IXAYKDDZKIZSPV-UHFFFAOYSA-M Synonym: chlorotris triphenylphosphine rhodium i,chlorotris triphenylphosphine rhodium,tris triphenylphosphine rhodium i chloride,tris triphenylphosphine chlororhodium,wilkinson's catalyst,unii-0fv534bkev,tris triphenylphosphine rhodium chloride,0fv534bkev,rhodium; triphenylphosphane; chloride PubChem CID: 84599 IUPAC Name: λ¹-rhodium(1+) tris(triphenylphosphane) chloride SMILES: [Cl-].[Rh+].C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 84599 |
|---|---|
| CAS | 14694-95-2 |
| Molecular Weight (g/mol) | 925.23 |
| MDL Number | MFCD00010016 |
| SMILES | [Cl-].[Rh+].C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | chlorotris triphenylphosphine rhodium i,chlorotris triphenylphosphine rhodium,tris triphenylphosphine rhodium i chloride,tris triphenylphosphine chlororhodium,wilkinson's catalyst,unii-0fv534bkev,tris triphenylphosphine rhodium chloride,0fv534bkev,rhodium; triphenylphosphane; chloride |
| IUPAC Name | λ¹-rhodium(1+) tris(triphenylphosphane) chloride |
| InChI Key | IXAYKDDZKIZSPV-UHFFFAOYSA-M |
| Molecular Formula | C54H45ClP3Rh |
Tetramethylammonium p-Toluenesulfonate 99.0+%, TCI America™
CAS: 3983-91-3 Molecular Formula: C11H19NO3S Molecular Weight (g/mol): 245.34 MDL Number: MFCD00043173 InChI Key: FHVCZJGBXWNGIZ-UHFFFAOYSA-M PubChem CID: 6451622 IUPAC Name: tetramethylazanium 4-methylbenzene-1-sulfonate SMILES: C[N+](C)(C)C.CC1=CC=C(C=C1)S([O-])(=O)=O
| PubChem CID | 6451622 |
|---|---|
| CAS | 3983-91-3 |
| Molecular Weight (g/mol) | 245.34 |
| MDL Number | MFCD00043173 |
| SMILES | C[N+](C)(C)C.CC1=CC=C(C=C1)S([O-])(=O)=O |
| IUPAC Name | tetramethylazanium 4-methylbenzene-1-sulfonate |
| InChI Key | FHVCZJGBXWNGIZ-UHFFFAOYSA-M |
| Molecular Formula | C11H19NO3S |
2-Formylbenzonitrile 99.0+%, TCI America™
CAS: 7468-67-9 Molecular Formula: C8H5NO Molecular Weight (g/mol): 131.13 MDL Number: MFCD00017503 InChI Key: QVTPWONEVZJCCS-UHFFFAOYSA-N Synonym: 2-cyanobenzaldehyde,o-cyanobenzaldehyde,benzonitrile, 2-formyl,cyanobenzaldehyde,2-formylbenzenecarbonitrile,2-cyano-benzaldehyde,2-formyl-benzonitrile,pubchem7409,#,acmc-1blgc PubChem CID: 101209 IUPAC Name: 2-formylbenzonitrile SMILES: O=CC1=CC=CC=C1C#N
| PubChem CID | 101209 |
|---|---|
| CAS | 7468-67-9 |
| Molecular Weight (g/mol) | 131.13 |
| MDL Number | MFCD00017503 |
| SMILES | O=CC1=CC=CC=C1C#N |
| Synonym | 2-cyanobenzaldehyde,o-cyanobenzaldehyde,benzonitrile, 2-formyl,cyanobenzaldehyde,2-formylbenzenecarbonitrile,2-cyano-benzaldehyde,2-formyl-benzonitrile,pubchem7409,#,acmc-1blgc |
| IUPAC Name | 2-formylbenzonitrile |
| InChI Key | QVTPWONEVZJCCS-UHFFFAOYSA-N |
| Molecular Formula | C8H5NO |
5-Methylsalicylic Acid 98.0+%, TCI America™
CAS: 89-56-5 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.149 MDL Number: MFCD00002461 InChI Key: DLGBEGBHXSAQOC-UHFFFAOYSA-N Synonym: 5-methylsalicylic acid,p-cresotic acid,p-cresotinic acid,6-hydroxy-m-toluic acid,p-homosalicylic acid,2,5-cresotic acid,benzoic acid, 2-hydroxy-5-methyl,5-methyl-2-hydroxybenzoic acid,6-hydroxy-3-methylbenzoic acid,alpha-cresotinic acid PubChem CID: 6973 IUPAC Name: 2-hydroxy-5-methylbenzoic acid SMILES: CC1=CC(=C(C=C1)O)C(=O)O
| PubChem CID | 6973 |
|---|---|
| CAS | 89-56-5 |
| Molecular Weight (g/mol) | 152.149 |
| MDL Number | MFCD00002461 |
| SMILES | CC1=CC(=C(C=C1)O)C(=O)O |
| Synonym | 5-methylsalicylic acid,p-cresotic acid,p-cresotinic acid,6-hydroxy-m-toluic acid,p-homosalicylic acid,2,5-cresotic acid,benzoic acid, 2-hydroxy-5-methyl,5-methyl-2-hydroxybenzoic acid,6-hydroxy-3-methylbenzoic acid,alpha-cresotinic acid |
| IUPAC Name | 2-hydroxy-5-methylbenzoic acid |
| InChI Key | DLGBEGBHXSAQOC-UHFFFAOYSA-N |
| Molecular Formula | C8H8O3 |
alpha,alpha'-Dichloro-m-xylene 96.0+%, TCI America™
CAS: 626-16-4 Molecular Formula: C8H8Cl2 Molecular Weight (g/mol): 175.052 MDL Number: MFCD00000912 InChI Key: GRJWOKACBGZOKT-UHFFFAOYSA-N Synonym: 1,3-bis chloromethyl benzene,alpha,alpha'-dichloro-m-xylene,m-xylylene dichloride,benzene, 1,3-bis chloromethyl,m-bis chloromethyl benzene,m-xylylene chloride,m-dichloroxylene,benzene, 1,3-dichloromethyl,ccris 1774,m-xylene, .alpha.,.alpha.'-dichloro PubChem CID: 12275 IUPAC Name: 1,3-bis(chloromethyl)benzene SMILES: C1=CC(=CC(=C1)CCl)CCl
| PubChem CID | 12275 |
|---|---|
| CAS | 626-16-4 |
| Molecular Weight (g/mol) | 175.052 |
| MDL Number | MFCD00000912 |
| SMILES | C1=CC(=CC(=C1)CCl)CCl |
| Synonym | 1,3-bis chloromethyl benzene,alpha,alpha'-dichloro-m-xylene,m-xylylene dichloride,benzene, 1,3-bis chloromethyl,m-bis chloromethyl benzene,m-xylylene chloride,m-dichloroxylene,benzene, 1,3-dichloromethyl,ccris 1774,m-xylene, .alpha.,.alpha.'-dichloro |
| IUPAC Name | 1,3-bis(chloromethyl)benzene |
| InChI Key | GRJWOKACBGZOKT-UHFFFAOYSA-N |
| Molecular Formula | C8H8Cl2 |
Letrozole 98.0+%, TCI America™
CAS: 112809-51-5 Molecular Formula: C17H11N5 Molecular Weight (g/mol): 285.31 MDL Number: MFCD00866241 InChI Key: HPJKCIUCZWXJDR-UHFFFAOYSA-N Synonym: letrozole,femara,4,4'-1h-1,2,4-triazol-1-yl methylene dibenzonitrile,letrozol,letoval,letrazole,femera,letrozole usan:inn,unii-7lkk855w8i,4,4'-1h-1,2,4-triazol-1-ylmethanediyl dibenzonitrile PubChem CID: 3902 ChEBI: CHEBI:6413 IUPAC Name: 4-[(4-cyanophenyl)-(1,2,4-triazol-1-yl)methyl]benzonitrile SMILES: C1=CC(=CC=C1C#N)C(C2=CC=C(C=C2)C#N)N3C=NC=N3
| PubChem CID | 3902 |
|---|---|
| CAS | 112809-51-5 |
| Molecular Weight (g/mol) | 285.31 |
| ChEBI | CHEBI:6413 |
| MDL Number | MFCD00866241 |
| SMILES | C1=CC(=CC=C1C#N)C(C2=CC=C(C=C2)C#N)N3C=NC=N3 |
| Synonym | letrozole,femara,4,4'-1h-1,2,4-triazol-1-yl methylene dibenzonitrile,letrozol,letoval,letrazole,femera,letrozole usan:inn,unii-7lkk855w8i,4,4'-1h-1,2,4-triazol-1-ylmethanediyl dibenzonitrile |
| IUPAC Name | 4-[(4-cyanophenyl)-(1,2,4-triazol-1-yl)methyl]benzonitrile |
| InChI Key | HPJKCIUCZWXJDR-UHFFFAOYSA-N |
| Molecular Formula | C17H11N5 |
Leflunomide 98.0+%, TCI America™
CAS: 75706-12-6 Molecular Formula: C12H9F3N2O2 Molecular Weight (g/mol): 270.211 MDL Number: MFCD00867593 InChI Key: VHOGYURTWQBHIL-UHFFFAOYSA-N Synonym: leflunomide,arava,leflunomidum,lefunamide,leflunomida,leflunomidum inn-latin,5-methyl-n-4-trifluoromethyl phenyl-1,2-oxazole-4-carboxamide,leflunomida inn-spanish,su 101 pharmaceutical,arava tn PubChem CID: 3899 ChEBI: CHEBI:6402 IUPAC Name: 5-methyl-N-[4-(trifluoromethyl)phenyl]-1,2-oxazole-4-carboxamide SMILES: CC1=C(C=NO1)C(=O)NC2=CC=C(C=C2)C(F)(F)F
| PubChem CID | 3899 |
|---|---|
| CAS | 75706-12-6 |
| Molecular Weight (g/mol) | 270.211 |
| ChEBI | CHEBI:6402 |
| MDL Number | MFCD00867593 |
| SMILES | CC1=C(C=NO1)C(=O)NC2=CC=C(C=C2)C(F)(F)F |
| Synonym | leflunomide,arava,leflunomidum,lefunamide,leflunomida,leflunomidum inn-latin,5-methyl-n-4-trifluoromethyl phenyl-1,2-oxazole-4-carboxamide,leflunomida inn-spanish,su 101 pharmaceutical,arava tn |
| IUPAC Name | 5-methyl-N-[4-(trifluoromethyl)phenyl]-1,2-oxazole-4-carboxamide |
| InChI Key | VHOGYURTWQBHIL-UHFFFAOYSA-N |
| Molecular Formula | C12H9F3N2O2 |
2-(2H-Benzotriazol-2-yl)-4,6-bis(1-methyl-1-phenylethyl)phenol 98.0+%, TCI America™
CAS: 70321-86-7 Molecular Formula: C30H29N3O Molecular Weight (g/mol): 447.582 MDL Number: MFCD00134705 InChI Key: OLFNXLXEGXRUOI-UHFFFAOYSA-N PubChem CID: 112412 IUPAC Name: 2-(benzotriazol-2-yl)-4,6-bis(2-phenylpropan-2-yl)phenol SMILES: CC(C)(C1=CC=CC=C1)C2=CC(=C(C(=C2)N3N=C4C=CC=CC4=N3)O)C(C)(C)C5=CC=CC=C5
| PubChem CID | 112412 |
|---|---|
| CAS | 70321-86-7 |
| Molecular Weight (g/mol) | 447.582 |
| MDL Number | MFCD00134705 |
| SMILES | CC(C)(C1=CC=CC=C1)C2=CC(=C(C(=C2)N3N=C4C=CC=CC4=N3)O)C(C)(C)C5=CC=CC=C5 |
| IUPAC Name | 2-(benzotriazol-2-yl)-4,6-bis(2-phenylpropan-2-yl)phenol |
| InChI Key | OLFNXLXEGXRUOI-UHFFFAOYSA-N |
| Molecular Formula | C30H29N3O |
1-Bromo-2,3,5,6-tetrafluorobenzene 97.0+%, TCI America™
CAS: 1559-88-2 Molecular Formula: C6HBrF4 Molecular Weight (g/mol): 228.97 MDL Number: MFCD00000308 InChI Key: YHAFCGSUIAFUCX-UHFFFAOYSA-N Synonym: 1-bromo-2,3,5,6-tetrafluorobenzene,2,3,5,6-tetrafluorobromobenzene,bromo-2,3,5,6-tetrafluorobenzene,1-bromo-2,3,5,6-tetrafluorbenzene,benzene, 3-bromo-1,2,4,5-tetrafluoro,2,3,5,6-tetrafluoro bromobenzene,2,3,5,6-tetrafluorobromo benzene,1,2,4,5-tetrafluoro-3-bromobenzene,pubchem2196,acmc-1bwvg PubChem CID: 73794 IUPAC Name: 3-bromo-1,2,4,5-tetrafluorobenzene SMILES: FC1=CC(F)=C(F)C(Br)=C1F
| PubChem CID | 73794 |
|---|---|
| CAS | 1559-88-2 |
| Molecular Weight (g/mol) | 228.97 |
| MDL Number | MFCD00000308 |
| SMILES | FC1=CC(F)=C(F)C(Br)=C1F |
| Synonym | 1-bromo-2,3,5,6-tetrafluorobenzene,2,3,5,6-tetrafluorobromobenzene,bromo-2,3,5,6-tetrafluorobenzene,1-bromo-2,3,5,6-tetrafluorbenzene,benzene, 3-bromo-1,2,4,5-tetrafluoro,2,3,5,6-tetrafluoro bromobenzene,2,3,5,6-tetrafluorobromo benzene,1,2,4,5-tetrafluoro-3-bromobenzene,pubchem2196,acmc-1bwvg |
| IUPAC Name | 3-bromo-1,2,4,5-tetrafluorobenzene |
| InChI Key | YHAFCGSUIAFUCX-UHFFFAOYSA-N |
| Molecular Formula | C6HBrF4 |