Benzene and substituted derivatives
Filtered Search Results
m-Xylylenediamine 99.0+%, TCI America™
CAS: 1477-55-0 Molecular Formula: C8H12N2 Molecular Weight (g/mol): 136.198 MDL Number: MFCD00008119 InChI Key: FDLQZKYLHJJBHD-UHFFFAOYSA-N Synonym: m-xylylenediamine,1,3-benzenedimethanamine,1,3-bis aminomethyl benzene,1,3-xylylenediamine,1,3-phenylenedimethanamine,m-xylylendiamin,1,3-xylenediamine,mxda,m-phenylenebis methylamine,methylamine, m-phenylenebis PubChem CID: 15133 IUPAC Name: [3-(aminomethyl)phenyl]methanamine SMILES: C1=CC(=CC(=C1)CN)CN
| PubChem CID | 15133 |
|---|---|
| CAS | 1477-55-0 |
| Molecular Weight (g/mol) | 136.198 |
| MDL Number | MFCD00008119 |
| SMILES | C1=CC(=CC(=C1)CN)CN |
| Synonym | m-xylylenediamine,1,3-benzenedimethanamine,1,3-bis aminomethyl benzene,1,3-xylylenediamine,1,3-phenylenedimethanamine,m-xylylendiamin,1,3-xylenediamine,mxda,m-phenylenebis methylamine,methylamine, m-phenylenebis |
| IUPAC Name | [3-(aminomethyl)phenyl]methanamine |
| InChI Key | FDLQZKYLHJJBHD-UHFFFAOYSA-N |
| Molecular Formula | C8H12N2 |
Methyl 4-Hydroxybenzoate 99.0+%, TCI America™
CAS: 99-76-3 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.149 MDL Number: MFCD00002352 InChI Key: LXCFILQKKLGQFO-UHFFFAOYSA-N Synonym: methylparaben,methyl paraben,methyl p-hydroxybenzoate,nipagin,methyl parahydroxybenzoate,maseptol,p-hydroxybenzoic acid methyl ester,4-hydroxybenzoic acid methyl ester,p-carbomethoxyphenol,tegosept m PubChem CID: 7456 ChEBI: CHEBI:31835 IUPAC Name: methyl 4-hydroxybenzoate SMILES: COC(=O)C1=CC=C(C=C1)O
| PubChem CID | 7456 |
|---|---|
| CAS | 99-76-3 |
| Molecular Weight (g/mol) | 152.149 |
| ChEBI | CHEBI:31835 |
| MDL Number | MFCD00002352 |
| SMILES | COC(=O)C1=CC=C(C=C1)O |
| Synonym | methylparaben,methyl paraben,methyl p-hydroxybenzoate,nipagin,methyl parahydroxybenzoate,maseptol,p-hydroxybenzoic acid methyl ester,4-hydroxybenzoic acid methyl ester,p-carbomethoxyphenol,tegosept m |
| IUPAC Name | methyl 4-hydroxybenzoate |
| InChI Key | LXCFILQKKLGQFO-UHFFFAOYSA-N |
| Molecular Formula | C8H8O3 |
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-(Trifluoromethyl)benzaldehyde 95.0+%, TCI America™
CAS: 455-19-6 Molecular Formula: C8H5F3O Molecular Weight (g/mol): 174.122 MDL Number: MFCD00006952 InChI Key: BEOBZEOPTQQELP-UHFFFAOYSA-N Synonym: 4-trifluoromethyl benzaldehyde,benzaldehyde, 4-trifluoromethyl,p-trifluoromethylbenzaldehyde,p-trifluoromethyl benzaldehyde,alpha,alpha,alpha-trifluoro-p-tolualdehyde,4'-trifluoromethyl benzaldehyde,p-trifluoromethyl-benzaldhyde,4-trifluoromethyl-benzaldehyde PubChem CID: 67996 IUPAC Name: 4-(trifluoromethyl)benzaldehyde SMILES: C1=CC(=CC=C1C=O)C(F)(F)F
| PubChem CID | 67996 |
|---|---|
| CAS | 455-19-6 |
| Molecular Weight (g/mol) | 174.122 |
| MDL Number | MFCD00006952 |
| SMILES | C1=CC(=CC=C1C=O)C(F)(F)F |
| Synonym | 4-trifluoromethyl benzaldehyde,benzaldehyde, 4-trifluoromethyl,p-trifluoromethylbenzaldehyde,p-trifluoromethyl benzaldehyde,alpha,alpha,alpha-trifluoro-p-tolualdehyde,4'-trifluoromethyl benzaldehyde,p-trifluoromethyl-benzaldhyde,4-trifluoromethyl-benzaldehyde |
| IUPAC Name | 4-(trifluoromethyl)benzaldehyde |
| InChI Key | BEOBZEOPTQQELP-UHFFFAOYSA-N |
| Molecular Formula | C8H5F3O |
p-Toluic Acid 98.0+%, TCI America™
CAS: 99-94-5 Molecular Formula: C8H8O2 Molecular Weight (g/mol): 136.15 MDL Number: MFCD00002565 InChI Key: LPNBBFKOUUSUDB-UHFFFAOYSA-N Synonym: p-toluic acid,4-toluic acid,crithminic acid,p-methylbenzoic acid,p-toluylic acid,benzoic acid, 4-methyl,p-carboxytoluene,para-toluic acid,4-methyl-benzoic acid,toluenecarboxylic acid PubChem CID: 7470 ChEBI: CHEBI:36635 IUPAC Name: 4-methylbenzoic acid SMILES: CC1=CC=C(C=C1)C(O)=O
| PubChem CID | 7470 |
|---|---|
| CAS | 99-94-5 |
| Molecular Weight (g/mol) | 136.15 |
| ChEBI | CHEBI:36635 |
| MDL Number | MFCD00002565 |
| SMILES | CC1=CC=C(C=C1)C(O)=O |
| Synonym | p-toluic acid,4-toluic acid,crithminic acid,p-methylbenzoic acid,p-toluylic acid,benzoic acid, 4-methyl,p-carboxytoluene,para-toluic acid,4-methyl-benzoic acid,toluenecarboxylic acid |
| IUPAC Name | 4-methylbenzoic acid |
| InChI Key | LPNBBFKOUUSUDB-UHFFFAOYSA-N |
| Molecular Formula | C8H8O2 |
5-Amino-2,4,6-triiodoisophthaloyl Dichloride 98.0+%, TCI America™
CAS: 37441-29-5 Molecular Formula: C8H2Cl2I3NO2 Molecular Weight (g/mol): 595.722 MDL Number: MFCD00270836 InChI Key: FBJVWRITWDYUAC-UHFFFAOYSA-N PubChem CID: 9894858 IUPAC Name: 5-amino-2,4,6-triiodobenzene-1,3-dicarbonyl chloride SMILES: C1(=C(C(=C(C(=C1I)N)I)C(=O)Cl)I)C(=O)Cl
| PubChem CID | 9894858 |
|---|---|
| CAS | 37441-29-5 |
| Molecular Weight (g/mol) | 595.722 |
| MDL Number | MFCD00270836 |
| SMILES | C1(=C(C(=C(C(=C1I)N)I)C(=O)Cl)I)C(=O)Cl |
| IUPAC Name | 5-amino-2,4,6-triiodobenzene-1,3-dicarbonyl chloride |
| InChI Key | FBJVWRITWDYUAC-UHFFFAOYSA-N |
| Molecular Formula | C8H2Cl2I3NO2 |
trans,trans-1,5-Diphenyl-1,4-pentadien-3-one 99.0+%, TCI America™
CAS: 35225-79-7 Molecular Formula: C17H14O Molecular Weight (g/mol): 234.30 MDL Number: MFCD00004790 InChI Key: WMKGGPCROCCUDY-PHEQNACWSA-N Synonym: dibenzylideneacetone,1,5-diphenylpenta-1,4-dien-3-one,trans,trans-dibenzylideneacetone,dibenzalacetone,1e,4e-1,5-diphenylpenta-1,4-dien-3-one,dibenzylidene acetone,distyryl ketone,1,5-diphenyl-1,4-pentadien-3-one,trans,trans-dibenzalacetone,trans,trans-1,5-diphenyl-1,4-pentadien-3-one PubChem CID: 640180 IUPAC Name: (1E,4E)-1,5-diphenylpenta-1,4-dien-3-one SMILES: O=C(\C=C\C1=CC=CC=C1)/C=C/C1=CC=CC=C1
| PubChem CID | 640180 |
|---|---|
| CAS | 35225-79-7 |
| Molecular Weight (g/mol) | 234.30 |
| MDL Number | MFCD00004790 |
| SMILES | O=C(\C=C\C1=CC=CC=C1)/C=C/C1=CC=CC=C1 |
| Synonym | dibenzylideneacetone,1,5-diphenylpenta-1,4-dien-3-one,trans,trans-dibenzylideneacetone,dibenzalacetone,1e,4e-1,5-diphenylpenta-1,4-dien-3-one,dibenzylidene acetone,distyryl ketone,1,5-diphenyl-1,4-pentadien-3-one,trans,trans-dibenzalacetone,trans,trans-1,5-diphenyl-1,4-pentadien-3-one |
| IUPAC Name | (1E,4E)-1,5-diphenylpenta-1,4-dien-3-one |
| InChI Key | WMKGGPCROCCUDY-PHEQNACWSA-N |
| Molecular Formula | C17H14O |
Hexafluorobenzene 99.0+%, TCI America™
CAS: 392-56-3 Molecular Formula: C6F6 Molecular Weight (g/mol): 186.056 MDL Number: MFCD00000288 InChI Key: ZQBFAOFFOQMSGJ-UHFFFAOYSA-N Synonym: hexafluorobenzene,perfluorobenzene,benzene, hexafluoro,hexafluorbenzol,unii-cmc18t611k,benzene, 1,2,3,4,5,6-hexafluoro,hexa fluorobenzene,hexafluoro benzene,pubchem18879,acmc-1bmus PubChem CID: 9805 ChEBI: CHEBI:38589 IUPAC Name: 1,2,3,4,5,6-hexafluorobenzene SMILES: C1(=C(C(=C(C(=C1F)F)F)F)F)F
| PubChem CID | 9805 |
|---|---|
| CAS | 392-56-3 |
| Molecular Weight (g/mol) | 186.056 |
| ChEBI | CHEBI:38589 |
| MDL Number | MFCD00000288 |
| SMILES | C1(=C(C(=C(C(=C1F)F)F)F)F)F |
| Synonym | hexafluorobenzene,perfluorobenzene,benzene, hexafluoro,hexafluorbenzol,unii-cmc18t611k,benzene, 1,2,3,4,5,6-hexafluoro,hexa fluorobenzene,hexafluoro benzene,pubchem18879,acmc-1bmus |
| IUPAC Name | 1,2,3,4,5,6-hexafluorobenzene |
| InChI Key | ZQBFAOFFOQMSGJ-UHFFFAOYSA-N |
| Molecular Formula | C6F6 |
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 |
2,6-Difluoroaniline 98.0+%, TCI America™
CAS: 5509-65-9 Molecular Formula: C6H5F2N Molecular Weight (g/mol): 129.11 MDL Number: MFCD00007655 InChI Key: ODUZJBKKYBQIBX-UHFFFAOYSA-N Synonym: benzenamine, 2,6-difluoro,2,6-difluoro-phenylamine,2,6-difluoro aniline,2,6-difluorobenzenamine,2,6-difluoranilin,2,6 difluoroaniline,2,6-diflouroaniline,pubchem4034,2,6-difuluoroaniline PubChem CID: 79647 IUPAC Name: 2,6-difluoroaniline SMILES: NC1=C(F)C=CC=C1F
| PubChem CID | 79647 |
|---|---|
| CAS | 5509-65-9 |
| Molecular Weight (g/mol) | 129.11 |
| MDL Number | MFCD00007655 |
| SMILES | NC1=C(F)C=CC=C1F |
| Synonym | benzenamine, 2,6-difluoro,2,6-difluoro-phenylamine,2,6-difluoro aniline,2,6-difluorobenzenamine,2,6-difluoranilin,2,6 difluoroaniline,2,6-diflouroaniline,pubchem4034,2,6-difuluoroaniline |
| IUPAC Name | 2,6-difluoroaniline |
| InChI Key | ODUZJBKKYBQIBX-UHFFFAOYSA-N |
| Molecular Formula | C6H5F2N |
3-Amino-4-fluorobenzotrifluoride 98.0+%, TCI America™
CAS: 535-52-4 Molecular Formula: C7H5F4N Molecular Weight (g/mol): 179.118 MDL Number: MFCD00007653 InChI Key: DRKWGMXFFCPZLW-UHFFFAOYSA-N Synonym: 2-fluoro-5-trifluoromethyl aniline,3-amino-4-fluorobenzotrifluoride,alpha,alpha,alpha,6-tetrafluoro-m-toluidine,4-fluoro-3-aminobenzotrifluoride,2-fluoro-5-trifluoromethyl benzenamine,2-fluoro-5-trifluoromethyl phenylamine,benzenamine, 2-fluoro-5-trifluoromethyl,.alpha.,.alpha.,.alpha.,6-tetrafluoro-m-toluidine,pubchem1538,ksc494s7l PubChem CID: 136349 IUPAC Name: 2-fluoro-5-(trifluoromethyl)aniline SMILES: C1=CC(=C(C=C1C(F)(F)F)N)F
| PubChem CID | 136349 |
|---|---|
| CAS | 535-52-4 |
| Molecular Weight (g/mol) | 179.118 |
| MDL Number | MFCD00007653 |
| SMILES | C1=CC(=C(C=C1C(F)(F)F)N)F |
| Synonym | 2-fluoro-5-trifluoromethyl aniline,3-amino-4-fluorobenzotrifluoride,alpha,alpha,alpha,6-tetrafluoro-m-toluidine,4-fluoro-3-aminobenzotrifluoride,2-fluoro-5-trifluoromethyl benzenamine,2-fluoro-5-trifluoromethyl phenylamine,benzenamine, 2-fluoro-5-trifluoromethyl,.alpha.,.alpha.,.alpha.,6-tetrafluoro-m-toluidine,pubchem1538,ksc494s7l |
| IUPAC Name | 2-fluoro-5-(trifluoromethyl)aniline |
| InChI Key | DRKWGMXFFCPZLW-UHFFFAOYSA-N |
| Molecular Formula | C7H5F4N |
2-Fluoroaniline 99.0+%, TCI America™
CAS: 348-54-9 Molecular Formula: C6H6FN Molecular Weight (g/mol): 111.12 MDL Number: MFCD00007642 InChI Key: FTZQXOJYPFINKJ-UHFFFAOYSA-N Synonym: o-fluoroaniline,benzenamine, 2-fluoro,1-amino-2-fluorobenzene,2-fluorobenzenamine,2-fluoro-phenylamine,2-fluoro-benzenamine,fluoroaniline-2,o-aminofluorobenzene,aniline, o-fluoro,2-fluorophenylamine PubChem CID: 9584 ChEBI: CHEBI:27526 IUPAC Name: 2-fluoroaniline SMILES: NC1=CC=CC=C1F
| PubChem CID | 9584 |
|---|---|
| CAS | 348-54-9 |
| Molecular Weight (g/mol) | 111.12 |
| ChEBI | CHEBI:27526 |
| MDL Number | MFCD00007642 |
| SMILES | NC1=CC=CC=C1F |
| Synonym | o-fluoroaniline,benzenamine, 2-fluoro,1-amino-2-fluorobenzene,2-fluorobenzenamine,2-fluoro-phenylamine,2-fluoro-benzenamine,fluoroaniline-2,o-aminofluorobenzene,aniline, o-fluoro,2-fluorophenylamine |
| IUPAC Name | 2-fluoroaniline |
| InChI Key | FTZQXOJYPFINKJ-UHFFFAOYSA-N |
| Molecular Formula | C6H6FN |
4-Nitrobenzyl Bromide 98.0+%, TCI America™
CAS: 100-11-8 Molecular Formula: C7H6BrNO2 Molecular Weight (g/mol): 216.03 MDL Number: MFCD00007373 InChI Key: VOLRSQPSJGXRNJ-UHFFFAOYSA-N Synonym: 4-nitrobenzyl bromide,1-bromomethyl-4-nitrobenzene,p-nitrobenzyl bromide,nitrobenzyl bromide,alpha-bromo-4-nitrotoluene,benzene, 1-bromomethyl-4-nitro,p-bromomethyl nitrobenzene,4-bromomethyl nitrobenzene,alpha-bromo-p-nitrotoluene,4-nitrobenzylbromide PubChem CID: 66011 ChEBI: CHEBI:62822 IUPAC Name: 1-(bromomethyl)-4-nitrobenzene SMILES: [O-][N+](=O)C1=CC=C(CBr)C=C1
| PubChem CID | 66011 |
|---|---|
| CAS | 100-11-8 |
| Molecular Weight (g/mol) | 216.03 |
| ChEBI | CHEBI:62822 |
| MDL Number | MFCD00007373 |
| SMILES | [O-][N+](=O)C1=CC=C(CBr)C=C1 |
| Synonym | 4-nitrobenzyl bromide,1-bromomethyl-4-nitrobenzene,p-nitrobenzyl bromide,nitrobenzyl bromide,alpha-bromo-4-nitrotoluene,benzene, 1-bromomethyl-4-nitro,p-bromomethyl nitrobenzene,4-bromomethyl nitrobenzene,alpha-bromo-p-nitrotoluene,4-nitrobenzylbromide |
| IUPAC Name | 1-(bromomethyl)-4-nitrobenzene |
| InChI Key | VOLRSQPSJGXRNJ-UHFFFAOYSA-N |
| Molecular Formula | C7H6BrNO2 |
4-Aminobenzyl Alcohol 98.0+%, TCI America™
CAS: 623-04-1 Molecular Formula: C7H9NO Molecular Weight (g/mol): 123.16 MDL Number: MFCD00014782 InChI Key: AXKGIPZJYUNAIW-UHFFFAOYSA-N Synonym: 4-aminobenzyl alcohol,4-aminophenyl methanol,4-aminobenzylalcohol,4-hydroxymethyl aniline,p-aminobenzyl alcohol,p-aminobenzylalcohol,benzenemethanol, 4-amino,benzyl alcohol, p-amino,4-amino-benzylalcohol,pubchem7480 PubChem CID: 69331 IUPAC Name: (4-aminophenyl)methanol SMILES: NC1=CC=C(CO)C=C1
| PubChem CID | 69331 |
|---|---|
| CAS | 623-04-1 |
| Molecular Weight (g/mol) | 123.16 |
| MDL Number | MFCD00014782 |
| SMILES | NC1=CC=C(CO)C=C1 |
| Synonym | 4-aminobenzyl alcohol,4-aminophenyl methanol,4-aminobenzylalcohol,4-hydroxymethyl aniline,p-aminobenzyl alcohol,p-aminobenzylalcohol,benzenemethanol, 4-amino,benzyl alcohol, p-amino,4-amino-benzylalcohol,pubchem7480 |
| IUPAC Name | (4-aminophenyl)methanol |
| InChI Key | AXKGIPZJYUNAIW-UHFFFAOYSA-N |
| Molecular Formula | C7H9NO |
2,2'-Methylenebis(6-tert-butyl-p-cresol) 99.0+%, TCI America™
CAS: 119-47-1 Molecular Formula: C23H32O2 Molecular Weight (g/mol): 340.51 MDL Number: MFCD00043641 InChI Key: KGRVJHAUYBGFFP-UHFFFAOYSA-N PubChem CID: 8398 IUPAC Name: 2-tert-butyl-6-[(3-tert-butyl-2-hydroxy-5-methylphenyl)methyl]-4-methylphenol SMILES: CC1=CC(CC2=CC(C)=CC(=C2O)C(C)(C)C)=C(O)C(=C1)C(C)(C)C
| PubChem CID | 8398 |
|---|---|
| CAS | 119-47-1 |
| Molecular Weight (g/mol) | 340.51 |
| MDL Number | MFCD00043641 |
| SMILES | CC1=CC(CC2=CC(C)=CC(=C2O)C(C)(C)C)=C(O)C(=C1)C(C)(C)C |
| IUPAC Name | 2-tert-butyl-6-[(3-tert-butyl-2-hydroxy-5-methylphenyl)methyl]-4-methylphenol |
| InChI Key | KGRVJHAUYBGFFP-UHFFFAOYSA-N |
| Molecular Formula | C23H32O2 |