Benzene and substituted derivatives
Filtered Search Results
N-Benzylethanolamine, 96%
CAS: 104-63-2 Molecular Formula: C9H13NO Molecular Weight (g/mol): 151.21 MDL Number: MFCD00002840 InChI Key: XNIOWJUQPMKCIJ-UHFFFAOYSA-N Synonym: n-benzylethanolamine,2-benzylamino ethanol,benzylaminoethanol,benzylethanolamine,ethanol, 2-phenylmethyl amino,2-benzylamino ethan-1-ol,benzyl ethanolamine,n-benzyle ethanol amine,ethanol, 2-benzylamino,unii-48121ms9jm PubChem CID: 4348 IUPAC Name: 2-(benzylamino)ethanol SMILES: OCCNCC1=CC=CC=C1
| PubChem CID | 4348 |
|---|---|
| CAS | 104-63-2 |
| Molecular Weight (g/mol) | 151.21 |
| MDL Number | MFCD00002840 |
| SMILES | OCCNCC1=CC=CC=C1 |
| Synonym | n-benzylethanolamine,2-benzylamino ethanol,benzylaminoethanol,benzylethanolamine,ethanol, 2-phenylmethyl amino,2-benzylamino ethan-1-ol,benzyl ethanolamine,n-benzyle ethanol amine,ethanol, 2-benzylamino,unii-48121ms9jm |
| IUPAC Name | 2-(benzylamino)ethanol |
| InChI Key | XNIOWJUQPMKCIJ-UHFFFAOYSA-N |
| Molecular Formula | C9H13NO |
3-(1H-Tetrazol-5-yl)benzoic acid, 97%
CAS: 73096-39-6 Molecular Formula: C8H6N4O2 Molecular Weight (g/mol): 190.162 MDL Number: MFCD03821131 InChI Key: MIERACSHCALJOM-UHFFFAOYSA-N Synonym: 3-1h-tetrazol-5-yl benzoic acid,3-2h-tetrazol-5-yl benzoic acid,3-1h-tetrazol-5-yl-benzoic acid,3-2h-1,2,3,4-tetrazol-5-yl benzoic acid,benzoic acid, 3-1h-tetrazol-5-yl,3-1h-1,2,3,4-tetrazol-5-yl benzoic acid,3-2h-tetrazol-5-yl-benzoic acid,3-1h-1,2,3,4-tetraazol-5-yl benzoic acid,3-1h-tetrazol-5-yl benzoicacid,3-1h-tetrazole-5-yl benzoic acid PubChem CID: 333942 IUPAC Name: 3-(2H-tetrazol-5-yl)benzoic acid SMILES: C1=CC(=CC(=C1)C(=O)O)C2=NNN=N2
| PubChem CID | 333942 |
|---|---|
| CAS | 73096-39-6 |
| Molecular Weight (g/mol) | 190.162 |
| MDL Number | MFCD03821131 |
| SMILES | C1=CC(=CC(=C1)C(=O)O)C2=NNN=N2 |
| Synonym | 3-1h-tetrazol-5-yl benzoic acid,3-2h-tetrazol-5-yl benzoic acid,3-1h-tetrazol-5-yl-benzoic acid,3-2h-1,2,3,4-tetrazol-5-yl benzoic acid,benzoic acid, 3-1h-tetrazol-5-yl,3-1h-1,2,3,4-tetrazol-5-yl benzoic acid,3-2h-tetrazol-5-yl-benzoic acid,3-1h-1,2,3,4-tetraazol-5-yl benzoic acid,3-1h-tetrazol-5-yl benzoicacid,3-1h-tetrazole-5-yl benzoic acid |
| IUPAC Name | 3-(2H-tetrazol-5-yl)benzoic acid |
| InChI Key | MIERACSHCALJOM-UHFFFAOYSA-N |
| Molecular Formula | C8H6N4O2 |
1-(4-Chlorophenyl)-1-methylethylamine, 97%
CAS: 17797-11-4 Molecular Formula: C9H12ClN Molecular Weight (g/mol): 169.65 MDL Number: MFCD08669636 InChI Key: JCUUNSQUTQELEZ-UHFFFAOYSA-N Synonym: 2-4-chlorophenyl propan-2-amine,1-4-chlorophenyl-1-methylethylamine,2-4-chlorophenyl prop-2-ylamine,4-chloro-alpha,alpha-dimethylbenzylamine,4-chlorocumylamine,alpha-amino-4-chlorocumene,2-4-chlorophenyl-2-propanamine,2-?4-chlorophenyl?propan-2-amine,benzenemethanamine,4-chloro-,a,,a-dimethyl,benzenemethanamine,4-chloro-a,a-dimethyl PubChem CID: 11030256 IUPAC Name: 2-(4-chlorophenyl)propan-2-amine SMILES: CC(C)(N)C1=CC=C(Cl)C=C1
| PubChem CID | 11030256 |
|---|---|
| CAS | 17797-11-4 |
| Molecular Weight (g/mol) | 169.65 |
| MDL Number | MFCD08669636 |
| SMILES | CC(C)(N)C1=CC=C(Cl)C=C1 |
| Synonym | 2-4-chlorophenyl propan-2-amine,1-4-chlorophenyl-1-methylethylamine,2-4-chlorophenyl prop-2-ylamine,4-chloro-alpha,alpha-dimethylbenzylamine,4-chlorocumylamine,alpha-amino-4-chlorocumene,2-4-chlorophenyl-2-propanamine,2-?4-chlorophenyl?propan-2-amine,benzenemethanamine,4-chloro-,a,,a-dimethyl,benzenemethanamine,4-chloro-a,a-dimethyl |
| IUPAC Name | 2-(4-chlorophenyl)propan-2-amine |
| InChI Key | JCUUNSQUTQELEZ-UHFFFAOYSA-N |
| Molecular Formula | C9H12ClN |
2-Amino-5-chlorobenzyl alcohol, 98%
CAS: 37585-25-4 Molecular Formula: C7H8ClNO Molecular Weight (g/mol): 157.597 MDL Number: MFCD00075163 InChI Key: CLKBZWDZDVOIGJ-UHFFFAOYSA-N PubChem CID: 586754 IUPAC Name: (2-amino-5-chlorophenyl)methanol SMILES: C1=CC(=C(C=C1Cl)CO)N
| PubChem CID | 586754 |
|---|---|
| CAS | 37585-25-4 |
| Molecular Weight (g/mol) | 157.597 |
| MDL Number | MFCD00075163 |
| SMILES | C1=CC(=C(C=C1Cl)CO)N |
| IUPAC Name | (2-amino-5-chlorophenyl)methanol |
| InChI Key | CLKBZWDZDVOIGJ-UHFFFAOYSA-N |
| Molecular Formula | C7H8ClNO |
4-Chloro-2-methoxybenzyl alcohol, 97%, Thermo Scientific Chemicals
CAS: 55685-75-1 Molecular Formula: C8H9ClO2 Molecular Weight (g/mol): 172.61 MDL Number: MFCD02683547 InChI Key: AXXPZAITCCIOIA-UHFFFAOYSA-N Synonym: 4-chloro-2-methoxybenzyl alcohol,4-chloro-2-methoxyphenyl methanol,4-chloro-2-methoxy-phenyl-methanol,benzenemethanol, 4-chloro-2-methoxy,4-chloro-2-methoxybenzyl alcohol 97 PubChem CID: 3549393 IUPAC Name: (4-chloro-2-methoxyphenyl)methanol SMILES: COC1=C(CO)C=CC(Cl)=C1
| PubChem CID | 3549393 |
|---|---|
| CAS | 55685-75-1 |
| Molecular Weight (g/mol) | 172.61 |
| MDL Number | MFCD02683547 |
| SMILES | COC1=C(CO)C=CC(Cl)=C1 |
| Synonym | 4-chloro-2-methoxybenzyl alcohol,4-chloro-2-methoxyphenyl methanol,4-chloro-2-methoxy-phenyl-methanol,benzenemethanol, 4-chloro-2-methoxy,4-chloro-2-methoxybenzyl alcohol 97 |
| IUPAC Name | (4-chloro-2-methoxyphenyl)methanol |
| InChI Key | AXXPZAITCCIOIA-UHFFFAOYSA-N |
| Molecular Formula | C8H9ClO2 |
3-Methylbenzoic anhydride, 97%
CAS: 21436-44-2 Molecular Formula: C16H14O3 Molecular Weight (g/mol): 254.285 MDL Number: MFCD00048083 InChI Key: DGZSQLHPEZFGSI-UHFFFAOYSA-N Synonym: 3-methylbenzoic anhydride,m-toluic anhydride,3-methylbenzene-1-carboxylic anhydride,benzoic acid, 3-methyl-, anhydride,3-methylbenzene-1-carboxylicanhydride,3-methylbenzoicanhydride,bis 3-methylbenzoic acid anhydride,3-methylbenzoyl 3-methylbenzoate,benzoic acid,3-methyl-, 1,1'-anhydride PubChem CID: 253301 IUPAC Name: (3-methylbenzoyl) 3-methylbenzoate SMILES: CC1=CC=CC(=C1)C(=O)OC(=O)C2=CC(=CC=C2)C
| PubChem CID | 253301 |
|---|---|
| CAS | 21436-44-2 |
| Molecular Weight (g/mol) | 254.285 |
| MDL Number | MFCD00048083 |
| SMILES | CC1=CC=CC(=C1)C(=O)OC(=O)C2=CC(=CC=C2)C |
| Synonym | 3-methylbenzoic anhydride,m-toluic anhydride,3-methylbenzene-1-carboxylic anhydride,benzoic acid, 3-methyl-, anhydride,3-methylbenzene-1-carboxylicanhydride,3-methylbenzoicanhydride,bis 3-methylbenzoic acid anhydride,3-methylbenzoyl 3-methylbenzoate,benzoic acid,3-methyl-, 1,1'-anhydride |
| IUPAC Name | (3-methylbenzoyl) 3-methylbenzoate |
| InChI Key | DGZSQLHPEZFGSI-UHFFFAOYSA-N |
| Molecular Formula | C16H14O3 |
1,2-Dibromo-3,4,5,6-tetramethylbenzene, 98%
CAS: 36321-73-0 Molecular Formula: C10H12Br2 Molecular Weight (g/mol): 292.014 MDL Number: MFCD00154987 InChI Key: VEZJOZSIGSNYEB-UHFFFAOYSA-N Synonym: benzene,1,2-dibromo-3,4,5,6-tetramethyl,pubchem21478,benzene, 1,2-dibromo-3,4,5,6-tetramethyl,1,2-bis bromanyl-3,4,5,6-tetramethyl-benzene PubChem CID: 2752606 IUPAC Name: 1,2-dibromo-3,4,5,6-tetramethylbenzene SMILES: CC1=C(C(=C(C(=C1C)Br)Br)C)C
| PubChem CID | 2752606 |
|---|---|
| CAS | 36321-73-0 |
| Molecular Weight (g/mol) | 292.014 |
| MDL Number | MFCD00154987 |
| SMILES | CC1=C(C(=C(C(=C1C)Br)Br)C)C |
| Synonym | benzene,1,2-dibromo-3,4,5,6-tetramethyl,pubchem21478,benzene, 1,2-dibromo-3,4,5,6-tetramethyl,1,2-bis bromanyl-3,4,5,6-tetramethyl-benzene |
| IUPAC Name | 1,2-dibromo-3,4,5,6-tetramethylbenzene |
| InChI Key | VEZJOZSIGSNYEB-UHFFFAOYSA-N |
| Molecular Formula | C10H12Br2 |
3-Chloro-5-fluorobenzyl alcohol, 98+%
CAS: 79944-64-2 Molecular Formula: C7H6ClFO Molecular Weight (g/mol): 160.57 MDL Number: MFCD03788554 InChI Key: VJTJBAMDTCIMOB-UHFFFAOYSA-N Synonym: 3-chloro-5-fluorobenzyl alcohol,3-chloro-5-fluorophenyl methanol,3-chloro-5-fluoro-phenyl methanol,rarechem al bd 1247,benzenemethanol,3-chloro-5-fluoro,3-chloro-5-fluoro phenyl methanol,3-chloro-5-fluoro-phenyl-methanol,3-chloro-5-fluorophenyl methan-1-ol PubChem CID: 2734835 IUPAC Name: (3-chloro-5-fluorophenyl)methanol SMILES: OCC1=CC(F)=CC(Cl)=C1
| PubChem CID | 2734835 |
|---|---|
| CAS | 79944-64-2 |
| Molecular Weight (g/mol) | 160.57 |
| MDL Number | MFCD03788554 |
| SMILES | OCC1=CC(F)=CC(Cl)=C1 |
| Synonym | 3-chloro-5-fluorobenzyl alcohol,3-chloro-5-fluorophenyl methanol,3-chloro-5-fluoro-phenyl methanol,rarechem al bd 1247,benzenemethanol,3-chloro-5-fluoro,3-chloro-5-fluoro phenyl methanol,3-chloro-5-fluoro-phenyl-methanol,3-chloro-5-fluorophenyl methan-1-ol |
| IUPAC Name | (3-chloro-5-fluorophenyl)methanol |
| InChI Key | VJTJBAMDTCIMOB-UHFFFAOYSA-N |
| Molecular Formula | C7H6ClFO |
4-Bromo-2-(trifluoromethyl)benzoic acid, 98%
CAS: 320-31-0 Molecular Formula: C8H4BrF3O2 Molecular Weight (g/mol): 269.02 MDL Number: MFCD07787468 InChI Key: JXHWAPDBDXPBEQ-UHFFFAOYSA-N Synonym: 4-bromo-2-trifluoromethyl benzoic acid,benzoic acid, 4-bromo-2-trifluoromethyl,2-trifluoromethyl-4-bromobenzoic acid,pubchem4738,4-bromo-2-trifluoromethyl benzoicacid,acmc-209hq4,ksc495g7n,5-bromo-2-carboxybenzotrifluoride PubChem CID: 25067392 IUPAC Name: 4-bromo-2-(trifluoromethyl)benzoic acid SMILES: OC(=O)C1=C(C=C(Br)C=C1)C(F)(F)F
| PubChem CID | 25067392 |
|---|---|
| CAS | 320-31-0 |
| Molecular Weight (g/mol) | 269.02 |
| MDL Number | MFCD07787468 |
| SMILES | OC(=O)C1=C(C=C(Br)C=C1)C(F)(F)F |
| Synonym | 4-bromo-2-trifluoromethyl benzoic acid,benzoic acid, 4-bromo-2-trifluoromethyl,2-trifluoromethyl-4-bromobenzoic acid,pubchem4738,4-bromo-2-trifluoromethyl benzoicacid,acmc-209hq4,ksc495g7n,5-bromo-2-carboxybenzotrifluoride |
| IUPAC Name | 4-bromo-2-(trifluoromethyl)benzoic acid |
| InChI Key | JXHWAPDBDXPBEQ-UHFFFAOYSA-N |
| Molecular Formula | C8H4BrF3O2 |
Methyl 2-iodo-5-methylbenzoate, 95%
CAS: 103440-52-4 Molecular Formula: C9H9IO2 Molecular Weight (g/mol): 276.07 MDL Number: MFCD12198129 InChI Key: DHYMLHOXGMUIDZ-UHFFFAOYSA-N PubChem CID: 14263946 IUPAC Name: methyl 2-iodo-5-methylbenzoate SMILES: COC(=O)C1=C(I)C=CC(C)=C1
| PubChem CID | 14263946 |
|---|---|
| CAS | 103440-52-4 |
| Molecular Weight (g/mol) | 276.07 |
| MDL Number | MFCD12198129 |
| SMILES | COC(=O)C1=C(I)C=CC(C)=C1 |
| IUPAC Name | methyl 2-iodo-5-methylbenzoate |
| InChI Key | DHYMLHOXGMUIDZ-UHFFFAOYSA-N |
| Molecular Formula | C9H9IO2 |
Methyl 4-fluorophenylacetate, 98%
CAS: 34837-84-8 Molecular Formula: C9H9FO2 Molecular Weight (g/mol): 168.167 MDL Number: MFCD00800608 InChI Key: AJPPKGMEHMXPMC-UHFFFAOYSA-N Synonym: methyl 2-4-fluorophenyl acetate,methyl 4-fluorophenylacetate,4-fluorophenylacetic acid methyl ester,pubchem24389,acmc-209iaq,methyl-4-fluorphenylacetate,methyl-4-fluorophenylacetate,methyl 4-fluorophenyl-acetate,methyl 4-fluorophenyl acetate PubChem CID: 2733233 IUPAC Name: methyl 2-(4-fluorophenyl)acetate SMILES: COC(=O)CC1=CC=C(C=C1)F
| PubChem CID | 2733233 |
|---|---|
| CAS | 34837-84-8 |
| Molecular Weight (g/mol) | 168.167 |
| MDL Number | MFCD00800608 |
| SMILES | COC(=O)CC1=CC=C(C=C1)F |
| Synonym | methyl 2-4-fluorophenyl acetate,methyl 4-fluorophenylacetate,4-fluorophenylacetic acid methyl ester,pubchem24389,acmc-209iaq,methyl-4-fluorphenylacetate,methyl-4-fluorophenylacetate,methyl 4-fluorophenyl-acetate,methyl 4-fluorophenyl acetate |
| IUPAC Name | methyl 2-(4-fluorophenyl)acetate |
| InChI Key | AJPPKGMEHMXPMC-UHFFFAOYSA-N |
| Molecular Formula | C9H9FO2 |
N-(4-Bromophenyl)benzenesulfonamide, 97%
CAS: 16468-97-6 Molecular Formula: C12H10BrNO2S Molecular Weight (g/mol): 312.181 MDL Number: MFCD00159375 InChI Key: HHLFFQAEABRCOJ-UHFFFAOYSA-N Synonym: n-4-bromophenyl benzenesulfonamide,benzenesulfonamide, n-4-bromophenyl,4'-bromobenzenesulfonanilide,benzenesulfonanilide, 4'-bromo,4-bromophenyl phenylsulfonyl amine,4/'-bromobenzenesulfonanilide,n-p-bromophenylbenzenesulphonamide,n-4-bromophenyl benzenesulfonamide # PubChem CID: 293101 IUPAC Name: N-(4-bromophenyl)benzenesulfonamide SMILES: C1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)Br
| PubChem CID | 293101 |
|---|---|
| CAS | 16468-97-6 |
| Molecular Weight (g/mol) | 312.181 |
| MDL Number | MFCD00159375 |
| SMILES | C1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)Br |
| Synonym | n-4-bromophenyl benzenesulfonamide,benzenesulfonamide, n-4-bromophenyl,4'-bromobenzenesulfonanilide,benzenesulfonanilide, 4'-bromo,4-bromophenyl phenylsulfonyl amine,4/'-bromobenzenesulfonanilide,n-p-bromophenylbenzenesulphonamide,n-4-bromophenyl benzenesulfonamide # |
| IUPAC Name | N-(4-bromophenyl)benzenesulfonamide |
| InChI Key | HHLFFQAEABRCOJ-UHFFFAOYSA-N |
| Molecular Formula | C12H10BrNO2S |
2-(Diphenylphosphino)benzaldehyde, 97%
CAS: 50777-76-9 Molecular Formula: C19H15OP Molecular Weight (g/mol): 290.30 MDL Number: MFCD00013367 InChI Key: DRCPJRZHAJMWOU-UHFFFAOYSA-N Synonym: 2-diphenylphosphino benzaldehyde,2-diphenylphosphinobenzaldehyde,o-diphenylphosphino benzaldehyde,2-formylphenyl diphenylphosphine,2-diphenylphosphanyl benzaldehyde,benzaldehyde, 2-diphenylphosphino,dppbde,zlchem 984,2-formylphenyldiphenylphosphine PubChem CID: 2754316 IUPAC Name: 2-(diphenylphosphanyl)benzaldehyde SMILES: O=CC1=CC=CC=C1P(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 2754316 |
|---|---|
| CAS | 50777-76-9 |
| Molecular Weight (g/mol) | 290.30 |
| MDL Number | MFCD00013367 |
| SMILES | O=CC1=CC=CC=C1P(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | 2-diphenylphosphino benzaldehyde,2-diphenylphosphinobenzaldehyde,o-diphenylphosphino benzaldehyde,2-formylphenyl diphenylphosphine,2-diphenylphosphanyl benzaldehyde,benzaldehyde, 2-diphenylphosphino,dppbde,zlchem 984,2-formylphenyldiphenylphosphine |
| IUPAC Name | 2-(diphenylphosphanyl)benzaldehyde |
| InChI Key | DRCPJRZHAJMWOU-UHFFFAOYSA-N |
| Molecular Formula | C19H15OP |
tert-Butyl phenyl carbonate, 97%
CAS: 6627-89-0 Molecular Formula: C11H14O3 Molecular Weight (g/mol): 194.23 MDL Number: MFCD00008804 InChI Key: UXWVQHXKKOGTSY-UHFFFAOYSA-N Synonym: t-butyl phenyl carbonate,tert-butylphenylcarbonate,2-methyl-2-propanyl phenyl carbonate,carbonic acid, 1,1-dimethylethyl phenyl ester,pubchem13300,acmc-209nuo,phenyl t-butyl carbonate,uxwvqhxkkogtsy-uhfffaoysa,tert-butyl phenyl carbonate,carbonic acid tert-butylphenyl ester PubChem CID: 81113 IUPAC Name: tert-butyl phenyl carbonate SMILES: CC(C)(C)OC(=O)OC1=CC=CC=C1
| PubChem CID | 81113 |
|---|---|
| CAS | 6627-89-0 |
| Molecular Weight (g/mol) | 194.23 |
| MDL Number | MFCD00008804 |
| SMILES | CC(C)(C)OC(=O)OC1=CC=CC=C1 |
| Synonym | t-butyl phenyl carbonate,tert-butylphenylcarbonate,2-methyl-2-propanyl phenyl carbonate,carbonic acid, 1,1-dimethylethyl phenyl ester,pubchem13300,acmc-209nuo,phenyl t-butyl carbonate,uxwvqhxkkogtsy-uhfffaoysa,tert-butyl phenyl carbonate,carbonic acid tert-butylphenyl ester |
| IUPAC Name | tert-butyl phenyl carbonate |
| InChI Key | UXWVQHXKKOGTSY-UHFFFAOYSA-N |
| Molecular Formula | C11H14O3 |
4-Phenoxybenzyl bromide, 97%
CAS: 36881-42-2 Molecular Formula: C13H11BrO Molecular Weight (g/mol): 263.134 MDL Number: MFCD04038693 InChI Key: CPIGBCFBFZSCQI-UHFFFAOYSA-N PubChem CID: 1514251 IUPAC Name: 1-(bromomethyl)-4-phenoxybenzene SMILES: C1=CC=C(C=C1)OC2=CC=C(C=C2)CBr
| PubChem CID | 1514251 |
|---|---|
| CAS | 36881-42-2 |
| Molecular Weight (g/mol) | 263.134 |
| MDL Number | MFCD04038693 |
| SMILES | C1=CC=C(C=C1)OC2=CC=C(C=C2)CBr |
| IUPAC Name | 1-(bromomethyl)-4-phenoxybenzene |
| InChI Key | CPIGBCFBFZSCQI-UHFFFAOYSA-N |
| Molecular Formula | C13H11BrO |