Benzene and substituted derivatives
Filtered Search Results
2-(Trifluoromethyl)phenylacetonitrile 98.0+%, TCI America™
CAS: 3038-47-9 Molecular Formula: C9H6F3N Molecular Weight (g/mol): 185.15 MDL Number: MFCD00001903 InChI Key: QXDCZSJGEUSERL-UHFFFAOYSA-N Synonym: 2-trifluoromethyl phenylacetonitrile,2-2-trifluoromethyl phenyl acetonitrile,2-trifluoromethyl benzyl cyanide,o-trifluoromethylbenzyl cyanide,2-trifluoromethylbenzyl cyanide,benzeneacetonitrile, 2-trifluoromethyl,o-trifluoromethylphenylacetonitrile,2-trifluoromethyl phenyl acetonitrile PubChem CID: 76435 IUPAC Name: 2-[2-(trifluoromethyl)phenyl]acetonitrile SMILES: FC(F)(F)C1=CC=CC=C1CC#N
| PubChem CID | 76435 |
|---|---|
| CAS | 3038-47-9 |
| Molecular Weight (g/mol) | 185.15 |
| MDL Number | MFCD00001903 |
| SMILES | FC(F)(F)C1=CC=CC=C1CC#N |
| Synonym | 2-trifluoromethyl phenylacetonitrile,2-2-trifluoromethyl phenyl acetonitrile,2-trifluoromethyl benzyl cyanide,o-trifluoromethylbenzyl cyanide,2-trifluoromethylbenzyl cyanide,benzeneacetonitrile, 2-trifluoromethyl,o-trifluoromethylphenylacetonitrile,2-trifluoromethyl phenyl acetonitrile |
| IUPAC Name | 2-[2-(trifluoromethyl)phenyl]acetonitrile |
| InChI Key | QXDCZSJGEUSERL-UHFFFAOYSA-N |
| Molecular Formula | C9H6F3N |
Methyl 3,4-Dihydroxybenzoate 98.0+%, TCI America™
CAS: 2150-43-8 Molecular Formula: C8H8O4 Molecular Weight (g/mol): 168.15 MDL Number: MFCD00016437 InChI Key: CUFLZUDASVUNOE-UHFFFAOYSA-N Synonym: methyl protocatechuate,protocatechuic acid, methyl ester,3,4-dihydroxybenzoic acid methyl ester,protocatechuic acid methyl ester,benzoic acid, 3,4-dihydroxy-, methyl ester,3,4-dihydroxymethylbenzoate,3,4-dihydroxybenzoic acid methyl,mdhb,methyl 3,4-dihydroxy,acmc-1cfbz PubChem CID: 287064 IUPAC Name: methyl 3,4-dihydroxybenzoate SMILES: COC(=O)C1=CC=C(O)C(O)=C1
| PubChem CID | 287064 |
|---|---|
| CAS | 2150-43-8 |
| Molecular Weight (g/mol) | 168.15 |
| MDL Number | MFCD00016437 |
| SMILES | COC(=O)C1=CC=C(O)C(O)=C1 |
| Synonym | methyl protocatechuate,protocatechuic acid, methyl ester,3,4-dihydroxybenzoic acid methyl ester,protocatechuic acid methyl ester,benzoic acid, 3,4-dihydroxy-, methyl ester,3,4-dihydroxymethylbenzoate,3,4-dihydroxybenzoic acid methyl,mdhb,methyl 3,4-dihydroxy,acmc-1cfbz |
| IUPAC Name | methyl 3,4-dihydroxybenzoate |
| InChI Key | CUFLZUDASVUNOE-UHFFFAOYSA-N |
| Molecular Formula | C8H8O4 |
(S)-(+)-alpha-Methoxy-alpha-(trifluoromethyl)phenylacetyl Chloride, TCI America™
CAS: 20445-33-4 Molecular Formula: C10H8ClF3O2 Molecular Weight (g/mol): 252.617 MDL Number: MFCD00067105 InChI Key: PAORVUMOXXAMPL-SECBINFHSA-N Synonym: s-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride,+-mtpa-cl,unii-472va70ul4,2s-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride,s-+-alpha-methoxy-alpha-trifluoromethylphenylacetyl chloride,s-+-a-methoxy-a-trifluoromethylphenylacetyl chloride,s-+-alpha-methoxy-alpha-trifluoromethylphenylacetylchloride,s-+-alpha-methoxy-alpha-trifluoromethyl phenylacetyl chloride,+-mtpa chloride,+-mosher's chloride PubChem CID: 2724611 IUPAC Name: (2S)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride SMILES: COC(C1=CC=CC=C1)(C(=O)Cl)C(F)(F)F
| PubChem CID | 2724611 |
|---|---|
| CAS | 20445-33-4 |
| Molecular Weight (g/mol) | 252.617 |
| MDL Number | MFCD00067105 |
| SMILES | COC(C1=CC=CC=C1)(C(=O)Cl)C(F)(F)F |
| Synonym | s-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride,+-mtpa-cl,unii-472va70ul4,2s-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride,s-+-alpha-methoxy-alpha-trifluoromethylphenylacetyl chloride,s-+-a-methoxy-a-trifluoromethylphenylacetyl chloride,s-+-alpha-methoxy-alpha-trifluoromethylphenylacetylchloride,s-+-alpha-methoxy-alpha-trifluoromethyl phenylacetyl chloride,+-mtpa chloride,+-mosher's chloride |
| IUPAC Name | (2S)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride |
| InChI Key | PAORVUMOXXAMPL-SECBINFHSA-N |
| Molecular Formula | C10H8ClF3O2 |
4-Methoxy-2-nitrobenzoic Acid 98.0+%, TCI America™
CAS: 33844-21-2 Molecular Formula: C8H7NO5 Molecular Weight (g/mol): 197.146 MDL Number: MFCD04972109 InChI Key: DVZBWONCSHFMMM-UHFFFAOYSA-N Synonym: 2-Nitro-p-anisic Acid PubChem CID: 288657 SMILES: COC1=CC(=C(C=C1)C(=O)O)[N+](=O)[O-]
| PubChem CID | 288657 |
|---|---|
| CAS | 33844-21-2 |
| Molecular Weight (g/mol) | 197.146 |
| MDL Number | MFCD04972109 |
| SMILES | COC1=CC(=C(C=C1)C(=O)O)[N+](=O)[O-] |
| Synonym | 2-Nitro-p-anisic Acid |
| InChI Key | DVZBWONCSHFMMM-UHFFFAOYSA-N |
| Molecular Formula | C8H7NO5 |
Methyl 3-Amino-5-bromo-2-methylbenzoate 98.0+%, TCI America™
CAS: 1000342-11-9 Molecular Formula: C9H10BrNO2 Molecular Weight (g/mol): 244.09 MDL Number: MFCD08690071 InChI Key: NMLOSXSDLWFBKT-UHFFFAOYSA-N Synonym: 3-Amino-5-bromo-2-methylbenzoic Acid Methyl Ester PubChem CID: 24729181 IUPAC Name: methyl 3-amino-5-bromo-2-methylbenzoate SMILES: COC(=O)C1=CC(Br)=CC(N)=C1C
| PubChem CID | 24729181 |
|---|---|
| CAS | 1000342-11-9 |
| Molecular Weight (g/mol) | 244.09 |
| MDL Number | MFCD08690071 |
| SMILES | COC(=O)C1=CC(Br)=CC(N)=C1C |
| Synonym | 3-Amino-5-bromo-2-methylbenzoic Acid Methyl Ester |
| IUPAC Name | methyl 3-amino-5-bromo-2-methylbenzoate |
| InChI Key | NMLOSXSDLWFBKT-UHFFFAOYSA-N |
| Molecular Formula | C9H10BrNO2 |
Ethyl 6-Methylsalicylate 98.0+%, TCI America™
CAS: 6555-40-4 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.203 MDL Number: MFCD01194299 InChI Key: KWXBNUYCDMPLEQ-UHFFFAOYSA-N Synonym: Ethyl 2-Hydroxy-6-methylbenzoate, 2-Hydroxy-6-methylbenzoic Acid Ethyl Ester, 6-Methylsalicylic Acid Ethyl Ester PubChem CID: 584222 IUPAC Name: ethyl 2-hydroxy-6-methylbenzoate SMILES: CCOC(=O)C1=C(C=CC=C1O)C
| PubChem CID | 584222 |
|---|---|
| CAS | 6555-40-4 |
| Molecular Weight (g/mol) | 180.203 |
| MDL Number | MFCD01194299 |
| SMILES | CCOC(=O)C1=C(C=CC=C1O)C |
| Synonym | Ethyl 2-Hydroxy-6-methylbenzoate, 2-Hydroxy-6-methylbenzoic Acid Ethyl Ester, 6-Methylsalicylic Acid Ethyl Ester |
| IUPAC Name | ethyl 2-hydroxy-6-methylbenzoate |
| InChI Key | KWXBNUYCDMPLEQ-UHFFFAOYSA-N |
| Molecular Formula | C10H12O3 |
4-Methylphthalic Acid 98.0+%, TCI America™
CAS: 4316-23-8 Molecular Formula: C9H8O4 Molecular Weight (g/mol): 180.159 MDL Number: MFCD00041946 InChI Key: CWJJAFQCTXFSTA-UHFFFAOYSA-N Synonym: 1,2-benzenedicarboxylic acid, 4-methyl,phthalic acid, 4-methyl,4-methyl phthalic acid,4-methyl-phthalic acid,4-methylbenzene-1,2-dicarboxylic acid,4-methyl-1,2-benzenedicarboxylic acid,4-methyl-o-phthalate,4-methylphthalicacid,acmc-1amca,4-methylphthalic acid PubChem CID: 20310 IUPAC Name: 4-methylphthalic acid SMILES: CC1=CC(=C(C=C1)C(=O)O)C(=O)O
| PubChem CID | 20310 |
|---|---|
| CAS | 4316-23-8 |
| Molecular Weight (g/mol) | 180.159 |
| MDL Number | MFCD00041946 |
| SMILES | CC1=CC(=C(C=C1)C(=O)O)C(=O)O |
| Synonym | 1,2-benzenedicarboxylic acid, 4-methyl,phthalic acid, 4-methyl,4-methyl phthalic acid,4-methyl-phthalic acid,4-methylbenzene-1,2-dicarboxylic acid,4-methyl-1,2-benzenedicarboxylic acid,4-methyl-o-phthalate,4-methylphthalicacid,acmc-1amca,4-methylphthalic acid |
| IUPAC Name | 4-methylphthalic acid |
| InChI Key | CWJJAFQCTXFSTA-UHFFFAOYSA-N |
| Molecular Formula | C9H8O4 |
1-Methyl-3-p-tolyltriazene 98.0+%, TCI America™
CAS: 21124-13-0 Molecular Formula: C8H11N3 Molecular Weight (g/mol): 149.197 MDL Number: MFCD00008282 InChI Key: DNGJVDGPCGXBFF-UHFFFAOYSA-N PubChem CID: 30492 IUPAC Name: 4-methyl-N-(methyldiazenyl)aniline SMILES: CC1=CC=C(C=C1)NN=NC
| PubChem CID | 30492 |
|---|---|
| CAS | 21124-13-0 |
| Molecular Weight (g/mol) | 149.197 |
| MDL Number | MFCD00008282 |
| SMILES | CC1=CC=C(C=C1)NN=NC |
| IUPAC Name | 4-methyl-N-(methyldiazenyl)aniline |
| InChI Key | DNGJVDGPCGXBFF-UHFFFAOYSA-N |
| Molecular Formula | C8H11N3 |
3-Methylbenzyl Alcohol 98.0+%, TCI America™
CAS: 587-03-1 Molecular Formula: C8H10O Molecular Weight (g/mol): 122.167 MDL Number: MFCD00004646 InChI Key: JJCKHVUTVOPLBV-UHFFFAOYSA-N Synonym: 3-methylbenzyl alcohol,3-methylphenyl methanol,m-tolyl carbinol,m-tolylmethanol,benzenemethanol, 3-methyl,unii-ttg38p37u6,m-methylbenzyl alcohol,3-methylbenzylalcohol,m-methyl benzyl alcohol,3-methyl-benzenemethanol PubChem CID: 11476 ChEBI: CHEBI:27995 IUPAC Name: (3-methylphenyl)methanol SMILES: CC1=CC(=CC=C1)CO
| PubChem CID | 11476 |
|---|---|
| CAS | 587-03-1 |
| Molecular Weight (g/mol) | 122.167 |
| ChEBI | CHEBI:27995 |
| MDL Number | MFCD00004646 |
| SMILES | CC1=CC(=CC=C1)CO |
| Synonym | 3-methylbenzyl alcohol,3-methylphenyl methanol,m-tolyl carbinol,m-tolylmethanol,benzenemethanol, 3-methyl,unii-ttg38p37u6,m-methylbenzyl alcohol,3-methylbenzylalcohol,m-methyl benzyl alcohol,3-methyl-benzenemethanol |
| IUPAC Name | (3-methylphenyl)methanol |
| InChI Key | JJCKHVUTVOPLBV-UHFFFAOYSA-N |
| Molecular Formula | C8H10O |
4-Bromobenzoic Acid 98.0+%, TCI America™
CAS: 586-76-5 Molecular Formula: C7H5BrO2 Molecular Weight (g/mol): 201.02 MDL Number: MFCD00002529 InChI Key: TUXYZHVUPGXXQG-UHFFFAOYSA-N Synonym: p-bromobenzoic acid,benzoic acid, 4-bromo,p-carboxybromobenzene,benzoic acid, p-bromo,p-bromobenzenecarboxylic acid,4-bromo-benzoic acid,4-brom-benzoesaeure,4-carboxybromobenzene,para bromo benzoic acid,4bromo-benzoic acid PubChem CID: 11464 ChEBI: CHEBI:60698 IUPAC Name: 4-bromobenzoic acid SMILES: OC(=O)C1=CC=C(Br)C=C1
| PubChem CID | 11464 |
|---|---|
| CAS | 586-76-5 |
| Molecular Weight (g/mol) | 201.02 |
| ChEBI | CHEBI:60698 |
| MDL Number | MFCD00002529 |
| SMILES | OC(=O)C1=CC=C(Br)C=C1 |
| Synonym | p-bromobenzoic acid,benzoic acid, 4-bromo,p-carboxybromobenzene,benzoic acid, p-bromo,p-bromobenzenecarboxylic acid,4-bromo-benzoic acid,4-brom-benzoesaeure,4-carboxybromobenzene,para bromo benzoic acid,4bromo-benzoic acid |
| IUPAC Name | 4-bromobenzoic acid |
| InChI Key | TUXYZHVUPGXXQG-UHFFFAOYSA-N |
| Molecular Formula | C7H5BrO2 |
2-Methylbenzhydrol 98.0+%, TCI America™
CAS: 5472-13-9 Molecular Formula: C14H14O Molecular Weight (g/mol): 198.265 MDL Number: MFCD00004490 InChI Key: MXHXXJOHFRHBFB-UHFFFAOYSA-N Synonym: 2-methylbenzhydrol,phenyl o-tolyl methanol,benzhydrol, 2-methyl,2-methylphenyl phenylmethanol,o-methylbenzhydrol,phenyl-o-tolyl-methanol,2-methylphenyl-phenylmethanol,benzenemethanol, 2-methyl-.alpha.-phenyl,2-methylphenyl phenyl methanol,phenyl-o-tolylcarbinol PubChem CID: 95659 IUPAC Name: (2-methylphenyl)-phenylmethanol SMILES: CC1=CC=CC=C1C(C2=CC=CC=C2)O
| PubChem CID | 95659 |
|---|---|
| CAS | 5472-13-9 |
| Molecular Weight (g/mol) | 198.265 |
| MDL Number | MFCD00004490 |
| SMILES | CC1=CC=CC=C1C(C2=CC=CC=C2)O |
| Synonym | 2-methylbenzhydrol,phenyl o-tolyl methanol,benzhydrol, 2-methyl,2-methylphenyl phenylmethanol,o-methylbenzhydrol,phenyl-o-tolyl-methanol,2-methylphenyl-phenylmethanol,benzenemethanol, 2-methyl-.alpha.-phenyl,2-methylphenyl phenyl methanol,phenyl-o-tolylcarbinol |
| IUPAC Name | (2-methylphenyl)-phenylmethanol |
| InChI Key | MXHXXJOHFRHBFB-UHFFFAOYSA-N |
| Molecular Formula | C14H14O |
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 |
4-Methoxyphenylacetic Anhydride 98.0+%, TCI America™
CAS: 3951-10-8 Molecular Formula: C18H18O5 Molecular Weight (g/mol): 314.34 MDL Number: MFCD00059089 InChI Key: KYCAEIXHUXBNTQ-UHFFFAOYSA-N PubChem CID: 14086930 IUPAC Name: [2-(4-methoxyphenyl)acetyl] 2-(4-methoxyphenyl)acetate SMILES: COC1=CC=C(C=C1)CC(=O)OC(=O)CC2=CC=C(C=C2)OC
| PubChem CID | 14086930 |
|---|---|
| CAS | 3951-10-8 |
| Molecular Weight (g/mol) | 314.34 |
| MDL Number | MFCD00059089 |
| SMILES | COC1=CC=C(C=C1)CC(=O)OC(=O)CC2=CC=C(C=C2)OC |
| IUPAC Name | [2-(4-methoxyphenyl)acetyl] 2-(4-methoxyphenyl)acetate |
| InChI Key | KYCAEIXHUXBNTQ-UHFFFAOYSA-N |
| Molecular Formula | C18H18O5 |
Methyl 3-Methoxy-2-nitrobenzoate 98.0+%, TCI America™
CAS: 5307-17-5 Molecular Formula: C9H9NO5 Molecular Weight (g/mol): 211.17 MDL Number: MFCD00051968 InChI Key: FDQQRLPHAAICCR-UHFFFAOYSA-N Synonym: benzoic acid, 3-methoxy-2-nitro-, methyl ester,3-methoxy-2-nitrobenzoic acid methyl ester,m-anisic acid, 2-nitro-, methyl ester,maybridge1_002124,cbmicro_008502,methyl 2-nitro-m-anisate,methyl 3-methoxy-2-nitro-benzoate,2-nitro-m-anisic acid methyl ester,3-methoxy-2-nitro-benzoic acid methyl ester PubChem CID: 79195 IUPAC Name: methyl 3-methoxy-2-nitrobenzoate SMILES: COC(=O)C1=CC=CC(OC)=C1[N+]([O-])=O
| PubChem CID | 79195 |
|---|---|
| CAS | 5307-17-5 |
| Molecular Weight (g/mol) | 211.17 |
| MDL Number | MFCD00051968 |
| SMILES | COC(=O)C1=CC=CC(OC)=C1[N+]([O-])=O |
| Synonym | benzoic acid, 3-methoxy-2-nitro-, methyl ester,3-methoxy-2-nitrobenzoic acid methyl ester,m-anisic acid, 2-nitro-, methyl ester,maybridge1_002124,cbmicro_008502,methyl 2-nitro-m-anisate,methyl 3-methoxy-2-nitro-benzoate,2-nitro-m-anisic acid methyl ester,3-methoxy-2-nitro-benzoic acid methyl ester |
| IUPAC Name | methyl 3-methoxy-2-nitrobenzoate |
| InChI Key | FDQQRLPHAAICCR-UHFFFAOYSA-N |
| Molecular Formula | C9H9NO5 |