Benzene and substituted derivatives
Filtered Search Results
2,4-Dibromoanisole, 98%, Thermo Scientific™
CAS: 21702-84-1 Molecular Formula: C7H6Br2O Molecular Weight (g/mol): 265.92 MDL Number: MFCD00000079 InChI Key: XGXUGXPKRBQINS-UHFFFAOYSA-N Synonym: 2,4-dibromoanisole,benzene, 2,4-dibromo-1-methoxy,benzene,2,4-dibromo-1-methoxy,pubchem3847,acmc-209fnf,maybridge1_003667,chemwish ic06728,2,4-dibromo-1-methoxy-benzene,xgxugxpkrbqins-uhfffaoysa,# PubChem CID: 27011 IUPAC Name: 2,4-dibromo-1-methoxybenzene SMILES: COC1=C(C=C(C=C1)Br)Br
| PubChem CID | 27011 |
|---|---|
| CAS | 21702-84-1 |
| Molecular Weight (g/mol) | 265.92 |
| MDL Number | MFCD00000079 |
| SMILES | COC1=C(C=C(C=C1)Br)Br |
| Synonym | 2,4-dibromoanisole,benzene, 2,4-dibromo-1-methoxy,benzene,2,4-dibromo-1-methoxy,pubchem3847,acmc-209fnf,maybridge1_003667,chemwish ic06728,2,4-dibromo-1-methoxy-benzene,xgxugxpkrbqins-uhfffaoysa,# |
| IUPAC Name | 2,4-dibromo-1-methoxybenzene |
| InChI Key | XGXUGXPKRBQINS-UHFFFAOYSA-N |
| Molecular Formula | C7H6Br2O |
(alpha,alpha,alpha-Trifluoro-p-tolyl)acetic acid, 98%
CAS: 32857-62-8 Molecular Formula: C9H7F3O2 Molecular Weight (g/mol): 204.15 MDL Number: MFCD00004352 InChI Key: HNORVZDAANCHAY-UHFFFAOYSA-N Synonym: 4-trifluoromethyl phenylacetic acid,2-4-trifluoromethyl phenyl acetic acid,4-trifluoromethylphenylacetic acid,4-trifluoromethyl phenyl acetic acid,alpha,alpha,alpha-trifluoro-p-tolyl acetic acid,benzeneacetic acid, 4-trifluoromethyl,p-trifluoromethyl phenylacetic acid,p-trifluoromethylphenylacetic acid,alpha,alpha,alpha-trifluoro-4-tolyl acetic acid PubChem CID: 118342 IUPAC Name: 2-[4-(trifluoromethyl)phenyl]acetic acid SMILES: OC(=O)CC1=CC=C(C=C1)C(F)(F)F
| PubChem CID | 118342 |
|---|---|
| CAS | 32857-62-8 |
| Molecular Weight (g/mol) | 204.15 |
| MDL Number | MFCD00004352 |
| SMILES | OC(=O)CC1=CC=C(C=C1)C(F)(F)F |
| Synonym | 4-trifluoromethyl phenylacetic acid,2-4-trifluoromethyl phenyl acetic acid,4-trifluoromethylphenylacetic acid,4-trifluoromethyl phenyl acetic acid,alpha,alpha,alpha-trifluoro-p-tolyl acetic acid,benzeneacetic acid, 4-trifluoromethyl,p-trifluoromethyl phenylacetic acid,p-trifluoromethylphenylacetic acid,alpha,alpha,alpha-trifluoro-4-tolyl acetic acid |
| IUPAC Name | 2-[4-(trifluoromethyl)phenyl]acetic acid |
| InChI Key | HNORVZDAANCHAY-UHFFFAOYSA-N |
| Molecular Formula | C9H7F3O2 |
BisphenolA, ≥99%, MilliporeSigma™ Supelco™
MDL Number: MFCD00002366 Synonym: 2,2-Bis(4-hydroxyphenyl)propane; 4,4 ′-Isopropylidenediphenol
| MDL Number | MFCD00002366 |
|---|---|
| Synonym | 2,2-Bis(4-hydroxyphenyl)propane; 4,4 ′-Isopropylidenediphenol |
4-Methoxybenzyl alcohol, 98%
CAS: 105-13-5 Molecular Formula: C8H10O2 Molecular Weight (g/mol): 138.17 MDL Number: MFCD00004653 InChI Key: MSHFRERJPWKJFX-UHFFFAOYSA-N Synonym: 4-methoxybenzyl alcohol,4-methoxyphenyl methanol,anise alcohol,anisyl alcohol,p-anisyl alcohol,p-methoxybenzyl alcohol,benzenemethanol, 4-methoxy,anisic alcohol,p-anisol alcohol,4-methoxybenzenemethanol PubChem CID: 7738 ChEBI: CHEBI:86918 IUPAC Name: (4-methoxyphenyl)methanol SMILES: COC1=CC=C(CO)C=C1
| PubChem CID | 7738 |
|---|---|
| CAS | 105-13-5 |
| Molecular Weight (g/mol) | 138.17 |
| ChEBI | CHEBI:86918 |
| MDL Number | MFCD00004653 |
| SMILES | COC1=CC=C(CO)C=C1 |
| Synonym | 4-methoxybenzyl alcohol,4-methoxyphenyl methanol,anise alcohol,anisyl alcohol,p-anisyl alcohol,p-methoxybenzyl alcohol,benzenemethanol, 4-methoxy,anisic alcohol,p-anisol alcohol,4-methoxybenzenemethanol |
| IUPAC Name | (4-methoxyphenyl)methanol |
| InChI Key | MSHFRERJPWKJFX-UHFFFAOYSA-N |
| Molecular Formula | C8H10O2 |
4-Cyanostyrene, 95%, stabilized
CAS: 3435-51-6 Molecular Formula: C9H7N Molecular Weight (g/mol): 129.16 MDL Number: MFCD00080445 InChI Key: SNTUCKQYWGHZPK-UHFFFAOYSA-N PubChem CID: 76967 IUPAC Name: 4-ethenylbenzonitrile SMILES: C=CC1=CC=C(C=C1)C#N
| PubChem CID | 76967 |
|---|---|
| CAS | 3435-51-6 |
| Molecular Weight (g/mol) | 129.16 |
| MDL Number | MFCD00080445 |
| SMILES | C=CC1=CC=C(C=C1)C#N |
| IUPAC Name | 4-ethenylbenzonitrile |
| InChI Key | SNTUCKQYWGHZPK-UHFFFAOYSA-N |
| Molecular Formula | C9H7N |
4-(Trifluoromethoxy)benzyl bromide, 98%, Thermo Scientific™
CAS: 50824-05-0 Molecular Formula: C8H6BrF3O Molecular Weight (g/mol): 255.03 MDL Number: MFCD00061238 InChI Key: JDNPUJCKXLOHOW-UHFFFAOYSA-N Synonym: 4-trifluoromethoxy benzyl bromide,1-bromomethyl-4-trifluoromethoxy benzene,4-trifluoromethoxybenzyl bromide,4-trifluoromethoxy benzylbromide,p-trifluoromethoxy benzyl bromide,alpha-bromo-4-trifluoromethoxy toluene,benzene, 1-bromomethyl-4-trifluoromethoxy,4-trifluoromethoxy-benzyl bromide,4-bromomethyl phenoxy trifluoromethane,1-bromomethyl-4-trifluoromethoxy-benzene PubChem CID: 142785 IUPAC Name: 1-(bromomethyl)-4-(trifluoromethoxy)benzene SMILES: C1=CC(=CC=C1CBr)OC(F)(F)F
| PubChem CID | 142785 |
|---|---|
| CAS | 50824-05-0 |
| Molecular Weight (g/mol) | 255.03 |
| MDL Number | MFCD00061238 |
| SMILES | C1=CC(=CC=C1CBr)OC(F)(F)F |
| Synonym | 4-trifluoromethoxy benzyl bromide,1-bromomethyl-4-trifluoromethoxy benzene,4-trifluoromethoxybenzyl bromide,4-trifluoromethoxy benzylbromide,p-trifluoromethoxy benzyl bromide,alpha-bromo-4-trifluoromethoxy toluene,benzene, 1-bromomethyl-4-trifluoromethoxy,4-trifluoromethoxy-benzyl bromide,4-bromomethyl phenoxy trifluoromethane,1-bromomethyl-4-trifluoromethoxy-benzene |
| IUPAC Name | 1-(bromomethyl)-4-(trifluoromethoxy)benzene |
| InChI Key | JDNPUJCKXLOHOW-UHFFFAOYSA-N |
| Molecular Formula | C8H6BrF3O |
alpha'-Bromo-alpha,alpha,alpha-trifluoro-p-xylene, 98%
CAS: 402-49-3 Molecular Formula: C8H6BrF3 Molecular Weight (g/mol): 239.04 MDL Number: MFCD00000403 InChI Key: IKSNDOVDVVPSMA-UHFFFAOYSA-N Synonym: 4-trifluoromethyl benzyl bromide,1-bromomethyl-4-trifluoromethyl benzene,4-trifluoromethylbenzyl bromide,4-bromomethyl benzotrifluoride,p-trifluoromethylbenzyl bromide,4-trifluoromethyl benzylbromide,benzene, 1-bromomethyl-4-trifluoromethyl,4-trifluoromethylbenzylbromide,p-trifluoromethyl benzyl bromide,alpha'-bromo-alpha,alpha,alpha-trifluoro-p-xylene PubChem CID: 123062 IUPAC Name: 1-(bromomethyl)-4-(trifluoromethyl)benzene SMILES: C1=CC(=CC=C1CBr)C(F)(F)F
| PubChem CID | 123062 |
|---|---|
| CAS | 402-49-3 |
| Molecular Weight (g/mol) | 239.04 |
| MDL Number | MFCD00000403 |
| SMILES | C1=CC(=CC=C1CBr)C(F)(F)F |
| Synonym | 4-trifluoromethyl benzyl bromide,1-bromomethyl-4-trifluoromethyl benzene,4-trifluoromethylbenzyl bromide,4-bromomethyl benzotrifluoride,p-trifluoromethylbenzyl bromide,4-trifluoromethyl benzylbromide,benzene, 1-bromomethyl-4-trifluoromethyl,4-trifluoromethylbenzylbromide,p-trifluoromethyl benzyl bromide,alpha'-bromo-alpha,alpha,alpha-trifluoro-p-xylene |
| IUPAC Name | 1-(bromomethyl)-4-(trifluoromethyl)benzene |
| InChI Key | IKSNDOVDVVPSMA-UHFFFAOYSA-N |
| Molecular Formula | C8H6BrF3 |
4-tert-Butylphenylboronic acid, 97%
CAS: 123324-71-0 Molecular Formula: C10H15BO2 Molecular Weight (g/mol): 178.04 MDL Number: MFCD01009697 InChI Key: MNJYZNVROSZZQC-UHFFFAOYSA-N Synonym: 4-t-butylphenylboronic acid,4-tert-butylbenzeneboronic acid,4-tert-butyl phenyl boronic acid,4-tert-butylphenyl boronic acid,4-tert-butyl phenylboronic acid,4-tert-butyl-phenyl boronic acid,4-tert-butylphenyl boranediol,p-t-butylphenylboronic acid,4-tertbutylphenylboronic acid PubChem CID: 2734320 IUPAC Name: (4-tert-butylphenyl)boronic acid SMILES: CC(C)(C)C1=CC=C(C=C1)B(O)O
| PubChem CID | 2734320 |
|---|---|
| CAS | 123324-71-0 |
| Molecular Weight (g/mol) | 178.04 |
| MDL Number | MFCD01009697 |
| SMILES | CC(C)(C)C1=CC=C(C=C1)B(O)O |
| Synonym | 4-t-butylphenylboronic acid,4-tert-butylbenzeneboronic acid,4-tert-butyl phenyl boronic acid,4-tert-butylphenyl boronic acid,4-tert-butyl phenylboronic acid,4-tert-butyl-phenyl boronic acid,4-tert-butylphenyl boranediol,p-t-butylphenylboronic acid,4-tertbutylphenylboronic acid |
| IUPAC Name | (4-tert-butylphenyl)boronic acid |
| InChI Key | MNJYZNVROSZZQC-UHFFFAOYSA-N |
| Molecular Formula | C10H15BO2 |
2,4-Bis(trifluoromethyl)benzoic acid, 98%, Thermo Scientific™
CAS: 32890-87-2 Molecular Formula: C9H4F6O2 Molecular Weight (g/mol): 258.12 MDL Number: MFCD00042496 InChI Key: JTOIZLCQNWWDCN-UHFFFAOYSA-N Synonym: 2,4-bis trifluoromethyl benzoic acid,2,4-bis-trifluoromethylbenzoic acid,2,4-di trifluoromethyl benzoic acid,benzoic acid, 2,4-bis trifluoromethyl,2,4-bis-trifluoromethyl-benzoic acid,maybridge4_003283,acmc-20aoeb,pubchem8491,rarechem al bo 0512 PubChem CID: 141752 IUPAC Name: 2,4-bis(trifluoromethyl)benzoic acid SMILES: C1=CC(=C(C=C1C(F)(F)F)C(F)(F)F)C(=O)O
| PubChem CID | 141752 |
|---|---|
| CAS | 32890-87-2 |
| Molecular Weight (g/mol) | 258.12 |
| MDL Number | MFCD00042496 |
| SMILES | C1=CC(=C(C=C1C(F)(F)F)C(F)(F)F)C(=O)O |
| Synonym | 2,4-bis trifluoromethyl benzoic acid,2,4-bis-trifluoromethylbenzoic acid,2,4-di trifluoromethyl benzoic acid,benzoic acid, 2,4-bis trifluoromethyl,2,4-bis-trifluoromethyl-benzoic acid,maybridge4_003283,acmc-20aoeb,pubchem8491,rarechem al bo 0512 |
| IUPAC Name | 2,4-bis(trifluoromethyl)benzoic acid |
| InChI Key | JTOIZLCQNWWDCN-UHFFFAOYSA-N |
| Molecular Formula | C9H4F6O2 |
4-tert-Butylcatechol, 99%
CAS: 98-29-3 Molecular Formula: C10H14O2 Molecular Weight (g/mol): 166.22 MDL Number: MFCD00002201 InChI Key: XESZUVZBAMCAEJ-UHFFFAOYSA-N Synonym: 4-tert-butylcatechol,p-tert-butylcatechol,4-tert-butylpyrocatechol,p-tert-butyl catechol,4-tert-butyl benzene-1,2-diol,4-t-butylpyrocatechol,p-tert-butylpyrocatechol,4-t-butylcatechol,1,2-benzenediol, 4-1,1-dimethylethyl,4-tert-butylcatechin PubChem CID: 7381 IUPAC Name: 4-tert-butylbenzene-1,2-diol SMILES: CC(C)(C)C1=CC=C(O)C(O)=C1
| PubChem CID | 7381 |
|---|---|
| CAS | 98-29-3 |
| Molecular Weight (g/mol) | 166.22 |
| MDL Number | MFCD00002201 |
| SMILES | CC(C)(C)C1=CC=C(O)C(O)=C1 |
| Synonym | 4-tert-butylcatechol,p-tert-butylcatechol,4-tert-butylpyrocatechol,p-tert-butyl catechol,4-tert-butyl benzene-1,2-diol,4-t-butylpyrocatechol,p-tert-butylpyrocatechol,4-t-butylcatechol,1,2-benzenediol, 4-1,1-dimethylethyl,4-tert-butylcatechin |
| IUPAC Name | 4-tert-butylbenzene-1,2-diol |
| InChI Key | XESZUVZBAMCAEJ-UHFFFAOYSA-N |
| Molecular Formula | C10H14O2 |
2-Bromo-4,5-dimethoxybenzyl alcohol, 98%
CAS: 54370-00-2 Molecular Formula: C9H11BrO3 Molecular Weight (g/mol): 247.088 MDL Number: MFCD02093896 InChI Key: SDZSRNYOXRHPHZ-UHFFFAOYSA-N Synonym: 2-bromo-4,5-dimethoxyphenyl methanol,2-bromo-4,5-dimethoxybenzyl alcohol,benzenemethanol, 2-bromo-4,5-dimethoxy,2-bromo-4,5-dimethoxyphenyl methan-1-ol,phenylmethanol, 2-bromo-4,5-dimethoxy,2-bromo-4,5-dimethoxy-phenyl-methanol,2-bromo-4,5-dimethoxyphenyl methanol #,2-bromanyl-4,5-dimethoxy-phenyl methanol PubChem CID: 618887 IUPAC Name: (2-bromo-4,5-dimethoxyphenyl)methanol SMILES: COC1=C(C=C(C(=C1)CO)Br)OC
| PubChem CID | 618887 |
|---|---|
| CAS | 54370-00-2 |
| Molecular Weight (g/mol) | 247.088 |
| MDL Number | MFCD02093896 |
| SMILES | COC1=C(C=C(C(=C1)CO)Br)OC |
| Synonym | 2-bromo-4,5-dimethoxyphenyl methanol,2-bromo-4,5-dimethoxybenzyl alcohol,benzenemethanol, 2-bromo-4,5-dimethoxy,2-bromo-4,5-dimethoxyphenyl methan-1-ol,phenylmethanol, 2-bromo-4,5-dimethoxy,2-bromo-4,5-dimethoxy-phenyl-methanol,2-bromo-4,5-dimethoxyphenyl methanol #,2-bromanyl-4,5-dimethoxy-phenyl methanol |
| IUPAC Name | (2-bromo-4,5-dimethoxyphenyl)methanol |
| InChI Key | SDZSRNYOXRHPHZ-UHFFFAOYSA-N |
| Molecular Formula | C9H11BrO3 |
4-Chloroanisole, 99%
CAS: 623-12-1 Molecular Formula: C7H7ClO Molecular Weight (g/mol): 142.58 InChI Key: YRGAYAGBVIXNAQ-UHFFFAOYSA-N Synonym: 4-chloroanisole,benzene, 1-chloro-4-methoxy,p-chloroanisole,p-chlorophenyl methyl ether,anisyl chloride,anisole, p-chloro,p-chloromethoxybenzene,4-chlorophenol methyl ether,1-chloro-4-methoxy-benzene,unii-0f18bly08q PubChem CID: 12167 IUPAC Name: 1-chloro-4-methoxybenzene SMILES: COC1=CC=C(C=C1)Cl
| PubChem CID | 12167 |
|---|---|
| CAS | 623-12-1 |
| Molecular Weight (g/mol) | 142.58 |
| SMILES | COC1=CC=C(C=C1)Cl |
| Synonym | 4-chloroanisole,benzene, 1-chloro-4-methoxy,p-chloroanisole,p-chlorophenyl methyl ether,anisyl chloride,anisole, p-chloro,p-chloromethoxybenzene,4-chlorophenol methyl ether,1-chloro-4-methoxy-benzene,unii-0f18bly08q |
| IUPAC Name | 1-chloro-4-methoxybenzene |
| InChI Key | YRGAYAGBVIXNAQ-UHFFFAOYSA-N |
| Molecular Formula | C7H7ClO |
1-Phenyl-1,2-propanedione, 98%
CAS: 579-07-7 Molecular Formula: C9H8O2 Molecular Weight (g/mol): 148.16 MDL Number: MFCD00008755 InChI Key: BVQVLAIMHVDZEL-UHFFFAOYSA-N Synonym: 1-phenyl-1,2-propanedione,acetylbenzoyl,acetyl benzoyl,benzoylacetyl,methylphenylglyoxal,pyruvophenone,1,2-propanedione, 1-phenyl,phenylmethyldiketone,benzoyl methyl ketone,methyl phenyl diketone PubChem CID: 11363 ChEBI: CHEBI:63552 IUPAC Name: 1-phenylpropane-1,2-dione SMILES: CC(=O)C(=O)C1=CC=CC=C1
| PubChem CID | 11363 |
|---|---|
| CAS | 579-07-7 |
| Molecular Weight (g/mol) | 148.16 |
| ChEBI | CHEBI:63552 |
| MDL Number | MFCD00008755 |
| SMILES | CC(=O)C(=O)C1=CC=CC=C1 |
| Synonym | 1-phenyl-1,2-propanedione,acetylbenzoyl,acetyl benzoyl,benzoylacetyl,methylphenylglyoxal,pyruvophenone,1,2-propanedione, 1-phenyl,phenylmethyldiketone,benzoyl methyl ketone,methyl phenyl diketone |
| IUPAC Name | 1-phenylpropane-1,2-dione |
| InChI Key | BVQVLAIMHVDZEL-UHFFFAOYSA-N |
| Molecular Formula | C9H8O2 |
Folinic acid, calcium salt, 99.4%, MP Biomedicals™
CAS: 1492-18-8 Molecular Formula: C20H21CaN7O7 Molecular Weight (g/mol): 511.51 MDL Number: MFCD00006704 InChI Key: KVUAALJSMIVURS-AEQORCIRNA-L Synonym: calcium folinate PubChem CID: 131675590 SMILES: [Ca++].NC1=NC(=O)C2=C(NCC(CNC3=CC=C(C=C3)C(=O)N[C@@H](CCC([O-])=O)C([O-])=O)N2C=O)N1
| PubChem CID | 131675590 |
|---|---|
| CAS | 1492-18-8 |
| Molecular Weight (g/mol) | 511.51 |
| MDL Number | MFCD00006704 |
| SMILES | [Ca++].NC1=NC(=O)C2=C(NCC(CNC3=CC=C(C=C3)C(=O)N[C@@H](CCC([O-])=O)C([O-])=O)N2C=O)N1 |
| Synonym | calcium folinate |
| InChI Key | KVUAALJSMIVURS-AEQORCIRNA-L |
| Molecular Formula | C20H21CaN7O7 |
4-Hydroxy-3-methoxybenzyl alcohol, 99%
CAS: 498-00-0 Molecular Formula: C8H10O3 Molecular Weight (g/mol): 154.17 MDL Number: MFCD00004659 InChI Key: ZENOXNGFMSCLLL-UHFFFAOYSA-N Synonym: vanillyl alcohol,4-hydroxy-3-methoxybenzyl alcohol,4-hydroxymethyl-2-methoxyphenol,vanillin alcohol,vanillic alcohol,4-hydroxy-3-methoxybenzenemethanol,benzenemethanol, 4-hydroxy-3-methoxy,vanillol,4-hydroxy-3-methoxybenzylalcohol,4-hydroxy-3-methoxyphenylmethanol PubChem CID: 62348 ChEBI: CHEBI:18353 IUPAC Name: 4-(hydroxymethyl)-2-methoxyphenol SMILES: COC1=CC(CO)=CC=C1O
| PubChem CID | 62348 |
|---|---|
| CAS | 498-00-0 |
| Molecular Weight (g/mol) | 154.17 |
| ChEBI | CHEBI:18353 |
| MDL Number | MFCD00004659 |
| SMILES | COC1=CC(CO)=CC=C1O |
| Synonym | vanillyl alcohol,4-hydroxy-3-methoxybenzyl alcohol,4-hydroxymethyl-2-methoxyphenol,vanillin alcohol,vanillic alcohol,4-hydroxy-3-methoxybenzenemethanol,benzenemethanol, 4-hydroxy-3-methoxy,vanillol,4-hydroxy-3-methoxybenzylalcohol,4-hydroxy-3-methoxyphenylmethanol |
| IUPAC Name | 4-(hydroxymethyl)-2-methoxyphenol |
| InChI Key | ZENOXNGFMSCLLL-UHFFFAOYSA-N |
| Molecular Formula | C8H10O3 |