Benzene and substituted derivatives
Filtered Search Results
4-Cyanobenzoic Acid 98.0+%, TCI America™
CAS: 619-65-8 Molecular Formula: C8H5NO2 Molecular Weight (g/mol): 147.133 MDL Number: MFCD00002528 InChI Key: ADCUEPOHPCPMCE-UHFFFAOYSA-N Synonym: p-cyanobenzoic acid,benzoic acid, 4-cyano,p-carboxybenzonitrile,4-carboxybenzonitrile,benzoic acid, p-cyano,4-cyano-benzoic acid,4-cyano benzoic acid,benzoicacid, 4-cyano,4-cyanobenzoicacid,para-cyanobenzoic acid PubChem CID: 12087 IUPAC Name: 4-cyanobenzoic acid SMILES: C1=CC(=CC=C1C#N)C(=O)O
| PubChem CID | 12087 |
|---|---|
| CAS | 619-65-8 |
| Molecular Weight (g/mol) | 147.133 |
| MDL Number | MFCD00002528 |
| SMILES | C1=CC(=CC=C1C#N)C(=O)O |
| Synonym | p-cyanobenzoic acid,benzoic acid, 4-cyano,p-carboxybenzonitrile,4-carboxybenzonitrile,benzoic acid, p-cyano,4-cyano-benzoic acid,4-cyano benzoic acid,benzoicacid, 4-cyano,4-cyanobenzoicacid,para-cyanobenzoic acid |
| IUPAC Name | 4-cyanobenzoic acid |
| InChI Key | ADCUEPOHPCPMCE-UHFFFAOYSA-N |
| Molecular Formula | C8H5NO2 |
4-Chlorobenzoic Acid 99.0+%, TCI America™
CAS: 74-11-3 Molecular Formula: C7H5ClO2 Molecular Weight (g/mol): 156.565 MDL Number: MFCD00002531 InChI Key: XRHGYUZYPHTUJZ-UHFFFAOYSA-N Synonym: p-chlorobenzoic acid,benzoic acid, 4-chloro,p-chlorbenzoic acid,chlorodracylic acid,benzoic acid, p-chloro,para-chlorobenzoic acid,4-chloro-benzoic acid,p-carboxychlorobenzene,acido p-clorobenzoico,acido p-clorobenzoico italian PubChem CID: 6318 ChEBI: CHEBI:30747 IUPAC Name: 4-chlorobenzoic acid SMILES: C1=CC(=CC=C1C(=O)O)Cl
| PubChem CID | 6318 |
|---|---|
| CAS | 74-11-3 |
| Molecular Weight (g/mol) | 156.565 |
| ChEBI | CHEBI:30747 |
| MDL Number | MFCD00002531 |
| SMILES | C1=CC(=CC=C1C(=O)O)Cl |
| Synonym | p-chlorobenzoic acid,benzoic acid, 4-chloro,p-chlorbenzoic acid,chlorodracylic acid,benzoic acid, p-chloro,para-chlorobenzoic acid,4-chloro-benzoic acid,p-carboxychlorobenzene,acido p-clorobenzoico,acido p-clorobenzoico italian |
| IUPAC Name | 4-chlorobenzoic acid |
| InChI Key | XRHGYUZYPHTUJZ-UHFFFAOYSA-N |
| Molecular Formula | C7H5ClO2 |
Benzenesulfohydroxamic Acid 98.0+%, TCI America™
CAS: 599-71-3 Molecular Formula: C6H7NO3S Molecular Weight (g/mol): 173.186 MDL Number: MFCD00025013 InChI Key: BRMDATNYMUMZLN-UHFFFAOYSA-N Synonym: piloty's acid,benzenesulfohydroxamic acid,benzenesulfonamide, n-hydroxy,benzenesulphonohydroxamic acid,benzsulfohydroxamic acid,hydroxamic acid, benzsulfo,n-phenylsulfonyl hydroxylamine,hydroxylamine, n-phenylsulfonyl,unii-c64l4umh19,n-hydroxy-benzenesulfonamide PubChem CID: 69033 IUPAC Name: N-hydroxybenzenesulfonamide SMILES: C1=CC=C(C=C1)S(=O)(=O)NO
| PubChem CID | 69033 |
|---|---|
| CAS | 599-71-3 |
| Molecular Weight (g/mol) | 173.186 |
| MDL Number | MFCD00025013 |
| SMILES | C1=CC=C(C=C1)S(=O)(=O)NO |
| Synonym | piloty's acid,benzenesulfohydroxamic acid,benzenesulfonamide, n-hydroxy,benzenesulphonohydroxamic acid,benzsulfohydroxamic acid,hydroxamic acid, benzsulfo,n-phenylsulfonyl hydroxylamine,hydroxylamine, n-phenylsulfonyl,unii-c64l4umh19,n-hydroxy-benzenesulfonamide |
| IUPAC Name | N-hydroxybenzenesulfonamide |
| InChI Key | BRMDATNYMUMZLN-UHFFFAOYSA-N |
| Molecular Formula | C6H7NO3S |
2-Bromobenzophenone 97.0+%, TCI America™
CAS: 13047-06-8 Molecular Formula: C13H9BrO Molecular Weight (g/mol): 261.12 MDL Number: MFCD00032462 InChI Key: ABEVIHIQUUXDMS-UHFFFAOYSA-N PubChem CID: 2735534 IUPAC Name: (2-bromophenyl)(phenyl)methanone SMILES: BrC1=CC=CC=C1C(=O)C1=CC=CC=C1
| PubChem CID | 2735534 |
|---|---|
| CAS | 13047-06-8 |
| Molecular Weight (g/mol) | 261.12 |
| MDL Number | MFCD00032462 |
| SMILES | BrC1=CC=CC=C1C(=O)C1=CC=CC=C1 |
| IUPAC Name | (2-bromophenyl)(phenyl)methanone |
| InChI Key | ABEVIHIQUUXDMS-UHFFFAOYSA-N |
| Molecular Formula | C13H9BrO |
3,4-Dimethoxybenzylamine 97.0+%, TCI America™
CAS: 5763-61-1 Molecular Formula: C9H13NO2 Molecular Weight (g/mol): 167.21 MDL Number: MFCD00008116 InChI Key: DIVNUTGTTIRPQA-UHFFFAOYSA-N Synonym: 3,4-dimethoxybenzylamine,veratrylamine,3,4-dimethoxyphenyl methanamine,benzenemethanamine, 3,4-dimethoxy,1-3,4-dimethoxyphenyl methanamine,benzylamine, 3,4-dimethoxy,3,4-dimethoxyphenyl methylamine,veratrylamin,pubchem7394,acmc-1altc PubChem CID: 79832 IUPAC Name: 1-(3,4-dimethoxyphenyl)methanamine SMILES: COC1=CC=C(CN)C=C1OC
| PubChem CID | 79832 |
|---|---|
| CAS | 5763-61-1 |
| Molecular Weight (g/mol) | 167.21 |
| MDL Number | MFCD00008116 |
| SMILES | COC1=CC=C(CN)C=C1OC |
| Synonym | 3,4-dimethoxybenzylamine,veratrylamine,3,4-dimethoxyphenyl methanamine,benzenemethanamine, 3,4-dimethoxy,1-3,4-dimethoxyphenyl methanamine,benzylamine, 3,4-dimethoxy,3,4-dimethoxyphenyl methylamine,veratrylamin,pubchem7394,acmc-1altc |
| IUPAC Name | 1-(3,4-dimethoxyphenyl)methanamine |
| InChI Key | DIVNUTGTTIRPQA-UHFFFAOYSA-N |
| Molecular Formula | C9H13NO2 |
Benzaldehyde Dimethyl Acetal 98.0+%, TCI America™
CAS: 1125-88-8 Molecular Formula: C9H12O2 Molecular Weight (g/mol): 152.193 MDL Number: MFCD00008491 InChI Key: HEVMDQBCAHEHDY-UHFFFAOYSA-N Synonym: benzaldehyde dimethyl acetal,dimethoxymethyl benzene,alpha,alpha-dimethoxytoluene,dimethoxyphenylmethane,benzene, dimethoxymethyl,benzaldehydedimethylacetal,dimethoxymethyl-benzene,benzaldehyde, dimethyl acetal,benzaldehyde dimethylacetal,unii-w6t83k35ca PubChem CID: 62375 IUPAC Name: dimethoxymethylbenzene SMILES: COC(C1=CC=CC=C1)OC
| PubChem CID | 62375 |
|---|---|
| CAS | 1125-88-8 |
| Molecular Weight (g/mol) | 152.193 |
| MDL Number | MFCD00008491 |
| SMILES | COC(C1=CC=CC=C1)OC |
| Synonym | benzaldehyde dimethyl acetal,dimethoxymethyl benzene,alpha,alpha-dimethoxytoluene,dimethoxyphenylmethane,benzene, dimethoxymethyl,benzaldehydedimethylacetal,dimethoxymethyl-benzene,benzaldehyde, dimethyl acetal,benzaldehyde dimethylacetal,unii-w6t83k35ca |
| IUPAC Name | dimethoxymethylbenzene |
| InChI Key | HEVMDQBCAHEHDY-UHFFFAOYSA-N |
| Molecular Formula | C9H12O2 |
Bis(2,4,6-trichlorophenyl) Oxalate 98.0+%, TCI America™
CAS: 1165-91-9 Molecular Formula: C14H4Cl6O4 Molecular Weight (g/mol): 448.882 MDL Number: MFCD00043061 InChI Key: GEVPIWPYWJZSPR-UHFFFAOYSA-N Synonym: bis 2,4,6-trichlorophenyl oxalate,bis 2,4,6-trichlorophenyl ethanedioate,oxalic acid bis 2,4,6-trichlorophenyl ester,2,4,6-trichlorophenyl oxalate,ethanedioic acid, bis 2,4,6-trichlorophenyl ester,bis-tcpo,acmc-20a7jt,gevpiwpywjzspr-uhfffaoysa PubChem CID: 160567 IUPAC Name: bis(2,4,6-trichlorophenyl) oxalate SMILES: C1=C(C=C(C(=C1Cl)OC(=O)C(=O)OC2=C(C=C(C=C2Cl)Cl)Cl)Cl)Cl
| PubChem CID | 160567 |
|---|---|
| CAS | 1165-91-9 |
| Molecular Weight (g/mol) | 448.882 |
| MDL Number | MFCD00043061 |
| SMILES | C1=C(C=C(C(=C1Cl)OC(=O)C(=O)OC2=C(C=C(C=C2Cl)Cl)Cl)Cl)Cl |
| Synonym | bis 2,4,6-trichlorophenyl oxalate,bis 2,4,6-trichlorophenyl ethanedioate,oxalic acid bis 2,4,6-trichlorophenyl ester,2,4,6-trichlorophenyl oxalate,ethanedioic acid, bis 2,4,6-trichlorophenyl ester,bis-tcpo,acmc-20a7jt,gevpiwpywjzspr-uhfffaoysa |
| IUPAC Name | bis(2,4,6-trichlorophenyl) oxalate |
| InChI Key | GEVPIWPYWJZSPR-UHFFFAOYSA-N |
| Molecular Formula | C14H4Cl6O4 |
N-Phenylthiourea 98.0+%, TCI America™
CAS: 103-85-5 Molecular Formula: C7H8N2S Molecular Weight (g/mol): 152.22 MDL Number: MFCD00004933 InChI Key: FULZLIGZKMKICU-UHFFFAOYSA-N Synonym: n-phenylthiourea,1-phenylthiourea,1-phenyl-2-thiourea,phenylthiocarbamide,thiourea, phenyl,phenyl-2-thiourea,fenylthiomocovina,urea, 1-phenyl-2-thio,rcra waste number p093,phenyl-thiourea PubChem CID: 676454 ChEBI: CHEBI:46261 IUPAC Name: phenylthiourea SMILES: NC(=S)NC1=CC=CC=C1
| PubChem CID | 676454 |
|---|---|
| CAS | 103-85-5 |
| Molecular Weight (g/mol) | 152.22 |
| ChEBI | CHEBI:46261 |
| MDL Number | MFCD00004933 |
| SMILES | NC(=S)NC1=CC=CC=C1 |
| Synonym | n-phenylthiourea,1-phenylthiourea,1-phenyl-2-thiourea,phenylthiocarbamide,thiourea, phenyl,phenyl-2-thiourea,fenylthiomocovina,urea, 1-phenyl-2-thio,rcra waste number p093,phenyl-thiourea |
| IUPAC Name | phenylthiourea |
| InChI Key | FULZLIGZKMKICU-UHFFFAOYSA-N |
| Molecular Formula | C7H8N2S |
3,5-Difluorobenzylamine 98.0+%, TCI America™
CAS: 90390-27-5 Molecular Formula: C7H7F2N Molecular Weight (g/mol): 143.14 MDL Number: MFCD00061244 InChI Key: VJNGGOMRUHYAMC-UHFFFAOYSA-N Synonym: 3,5-difluorobenzylamine,3,5-difluorophenyl methanamine,benzenemethanamine, 3,5-difluoro,1-3,5-difluorophenyl methanamine,3,5-difluorobenzyl amine,3,5-difluorophenyl methylamine,3, 5-difluorobenzylamine,pubchem4409,3,5-difluoro-benzylamine,3,5-difluoro-benzyl amine PubChem CID: 145211 IUPAC Name: 1-(3,5-difluorophenyl)methanamine SMILES: NCC1=CC(F)=CC(F)=C1
| PubChem CID | 145211 |
|---|---|
| CAS | 90390-27-5 |
| Molecular Weight (g/mol) | 143.14 |
| MDL Number | MFCD00061244 |
| SMILES | NCC1=CC(F)=CC(F)=C1 |
| Synonym | 3,5-difluorobenzylamine,3,5-difluorophenyl methanamine,benzenemethanamine, 3,5-difluoro,1-3,5-difluorophenyl methanamine,3,5-difluorobenzyl amine,3,5-difluorophenyl methylamine,3, 5-difluorobenzylamine,pubchem4409,3,5-difluoro-benzylamine,3,5-difluoro-benzyl amine |
| IUPAC Name | 1-(3,5-difluorophenyl)methanamine |
| InChI Key | VJNGGOMRUHYAMC-UHFFFAOYSA-N |
| Molecular Formula | C7H7F2N |
4-tert-Amylphenol 98.0+%, TCI America™
CAS: 80-46-6 Molecular Formula: C11H16O Molecular Weight (g/mol): 164.248 MDL Number: MFCD00002369 InChI Key: NRZWYNLTFLDQQX-UHFFFAOYSA-N Synonym: 4-tert-amylphenol,4-tert-pentylphenol,p-tert-amylphenol,p-tert-pentylphenol,4-t-amylphenol,4-1,1-dimethylpropyl phenol,amilphenol,amilfenol,pentaphen,tert-amylphenol PubChem CID: 6643 ChEBI: CHEBI:35096 IUPAC Name: 4-(2-methylbutan-2-yl)phenol SMILES: CCC(C)(C)C1=CC=C(C=C1)O
| PubChem CID | 6643 |
|---|---|
| CAS | 80-46-6 |
| Molecular Weight (g/mol) | 164.248 |
| ChEBI | CHEBI:35096 |
| MDL Number | MFCD00002369 |
| SMILES | CCC(C)(C)C1=CC=C(C=C1)O |
| Synonym | 4-tert-amylphenol,4-tert-pentylphenol,p-tert-amylphenol,p-tert-pentylphenol,4-t-amylphenol,4-1,1-dimethylpropyl phenol,amilphenol,amilfenol,pentaphen,tert-amylphenol |
| IUPAC Name | 4-(2-methylbutan-2-yl)phenol |
| InChI Key | NRZWYNLTFLDQQX-UHFFFAOYSA-N |
| Molecular Formula | C11H16O |
2,4-Di-tert-amylphenol 98.0+%, TCI America™
CAS: 120-95-6 Molecular Formula: C16H26O Molecular Weight (g/mol): 234.38 MDL Number: MFCD00041929 InChI Key: WMVJWKURWRGJCI-UHFFFAOYSA-N Synonym: 2,4-di-tert-pentylphenol,2,4-di-tert-amylphenol,2,4-di-t-pentylphenol,2,4-bis 1,1-dimethylpropyl phenol,phenol, 2,4-bis 1,1-dimethylpropyl,di-tert-amylphenol,prodox 156,phenol, 2,4-di-tert-pentyl,2,4-bis 2-methylbutan-2-yl phenol,unii-852f1hp88h PubChem CID: 8455 IUPAC Name: 2,4-bis(2-methylbutan-2-yl)phenol SMILES: CCC(C)(C)C1=CC=C(O)C(=C1)C(C)(C)CC
| PubChem CID | 8455 |
|---|---|
| CAS | 120-95-6 |
| Molecular Weight (g/mol) | 234.38 |
| MDL Number | MFCD00041929 |
| SMILES | CCC(C)(C)C1=CC=C(O)C(=C1)C(C)(C)CC |
| Synonym | 2,4-di-tert-pentylphenol,2,4-di-tert-amylphenol,2,4-di-t-pentylphenol,2,4-bis 1,1-dimethylpropyl phenol,phenol, 2,4-bis 1,1-dimethylpropyl,di-tert-amylphenol,prodox 156,phenol, 2,4-di-tert-pentyl,2,4-bis 2-methylbutan-2-yl phenol,unii-852f1hp88h |
| IUPAC Name | 2,4-bis(2-methylbutan-2-yl)phenol |
| InChI Key | WMVJWKURWRGJCI-UHFFFAOYSA-N |
| Molecular Formula | C16H26O |
Tolylene-2,6-diisocyanate 98.0+%, TCI America™
CAS: 91-08-7 Molecular Formula: C9H6N2O2 Molecular Weight (g/mol): 174.159 MDL Number: MFCD00002010 InChI Key: RUELTTOHQODFPA-UHFFFAOYSA-N Synonym: 2,6-diisocyanatotoluene,toluene-2,6-diisocyanate,2,6-toluene diisocyanate,2-methyl-m-phenylene diisocyanate,2,6-tdi,m-tolylene diisocyanate,meta-tolylene diisocyanate,toluene 2,6-diisocyanate,benzene, 1,3-diisocyanato-2-methyl,2,6-diisocyanato-1-methylbenzene PubChem CID: 7040 ChEBI: CHEBI:53557 IUPAC Name: 1,3-diisocyanato-2-methylbenzene SMILES: CC1=C(C=CC=C1N=C=O)N=C=O
| PubChem CID | 7040 |
|---|---|
| CAS | 91-08-7 |
| Molecular Weight (g/mol) | 174.159 |
| ChEBI | CHEBI:53557 |
| MDL Number | MFCD00002010 |
| SMILES | CC1=C(C=CC=C1N=C=O)N=C=O |
| Synonym | 2,6-diisocyanatotoluene,toluene-2,6-diisocyanate,2,6-toluene diisocyanate,2-methyl-m-phenylene diisocyanate,2,6-tdi,m-tolylene diisocyanate,meta-tolylene diisocyanate,toluene 2,6-diisocyanate,benzene, 1,3-diisocyanato-2-methyl,2,6-diisocyanato-1-methylbenzene |
| IUPAC Name | 1,3-diisocyanato-2-methylbenzene |
| InChI Key | RUELTTOHQODFPA-UHFFFAOYSA-N |
| Molecular Formula | C9H6N2O2 |
2-Hydroxybenzoic Acid 99.5+%, TCI America™
CAS: 69-72-7 Molecular Formula: C7H6O3 Molecular Weight (g/mol): 138.12 MDL Number: MFCD00002439 InChI Key: YGSDEFSMJLZEOE-UHFFFAOYSA-N Synonym: salicylic acid,o-hydroxybenzoic acid,2-carboxyphenol,o-carboxyphenol,rutranex,salonil,retarder w,keralyt,duoplant,freezone PubChem CID: 338 ChEBI: CHEBI:16914 IUPAC Name: 2-hydroxybenzoic acid SMILES: OC(=O)C1=CC=CC=C1O
| PubChem CID | 338 |
|---|---|
| CAS | 69-72-7 |
| Molecular Weight (g/mol) | 138.12 |
| ChEBI | CHEBI:16914 |
| MDL Number | MFCD00002439 |
| SMILES | OC(=O)C1=CC=CC=C1O |
| Synonym | salicylic acid,o-hydroxybenzoic acid,2-carboxyphenol,o-carboxyphenol,rutranex,salonil,retarder w,keralyt,duoplant,freezone |
| IUPAC Name | 2-hydroxybenzoic acid |
| InChI Key | YGSDEFSMJLZEOE-UHFFFAOYSA-N |
| Molecular Formula | C7H6O3 |
Methyl 2-Methyl-5-nitrobenzoate 98.0+%, TCI America™
CAS: 77324-87-9 Molecular Formula: C9H9NO4 Molecular Weight (g/mol): 195.174 InChI Key: TVGKPVDDCDQBRC-UHFFFAOYSA-N Synonym: methyl 5-nitro-2-methylbenzoate,2-methyl-5-nitro-benzoic acid methyl ester,2-methyl-5-nitrobenzoic acid methyl ester,methyl2-methyl-5-nitrobenzoate,methyl 3-nitro-6-methylbenzoate,benzoic acid, 2-methyl-5-nitro-, methyl ester,methyl 2-methyl-5-nitro-benzoate,acmc-1bix6,methyl 5-nitro-o-toluate,ksc495s6b PubChem CID: 4377758 IUPAC Name: methyl 2-methyl-5-nitrobenzoate SMILES: CC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OC
| PubChem CID | 4377758 |
|---|---|
| CAS | 77324-87-9 |
| Molecular Weight (g/mol) | 195.174 |
| SMILES | CC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OC |
| Synonym | methyl 5-nitro-2-methylbenzoate,2-methyl-5-nitro-benzoic acid methyl ester,2-methyl-5-nitrobenzoic acid methyl ester,methyl2-methyl-5-nitrobenzoate,methyl 3-nitro-6-methylbenzoate,benzoic acid, 2-methyl-5-nitro-, methyl ester,methyl 2-methyl-5-nitro-benzoate,acmc-1bix6,methyl 5-nitro-o-toluate,ksc495s6b |
| IUPAC Name | methyl 2-methyl-5-nitrobenzoate |
| InChI Key | TVGKPVDDCDQBRC-UHFFFAOYSA-N |
| Molecular Formula | C9H9NO4 |
p-Tolualdehyde 98.0+%, TCI America™
CAS: 104-87-0 Molecular Formula: C8H8O Molecular Weight (g/mol): 120.151 MDL Number: MFCD00006954 InChI Key: FXLOVSHXALFLKQ-UHFFFAOYSA-N Synonym: p-tolualdehyde,4-tolualdehyde,p-formyltoluene,p-tolylaldehyde,p-toluylaldehyde,p-methylbenzaldehyde,para-tolualdehyde,benzaldehyde, 4-methyl,para-methylbenzaldehyde,para-toluyl aldehyde PubChem CID: 7725 ChEBI: CHEBI:28617 IUPAC Name: 4-methylbenzaldehyde SMILES: CC1=CC=C(C=C1)C=O
| PubChem CID | 7725 |
|---|---|
| CAS | 104-87-0 |
| Molecular Weight (g/mol) | 120.151 |
| ChEBI | CHEBI:28617 |
| MDL Number | MFCD00006954 |
| SMILES | CC1=CC=C(C=C1)C=O |
| Synonym | p-tolualdehyde,4-tolualdehyde,p-formyltoluene,p-tolylaldehyde,p-toluylaldehyde,p-methylbenzaldehyde,para-tolualdehyde,benzaldehyde, 4-methyl,para-methylbenzaldehyde,para-toluyl aldehyde |
| IUPAC Name | 4-methylbenzaldehyde |
| InChI Key | FXLOVSHXALFLKQ-UHFFFAOYSA-N |
| Molecular Formula | C8H8O |