Benzene and substituted derivatives
Filtered Search Results
Benztropine Mesylate, MP Biomedicals™
CAS: 132-17-2 Molecular Formula: C22H29NO4S Molecular Weight (g/mol): 403.54 MDL Number: MFCD00074784 InChI Key: CPFJLLXFNPCTDW-STYNFMPRSA-N Synonym: benztropine mesylate,cogentin,benztropine mesilate,benztropine methanesulfonate,unii-wmj8tl7510,benztropine methylsulfonate,benzatropine mesilate,benzatropine mesylate,benzotropine mesylate,cobrentin methanesulfonate PubChem CID: 3246155 SMILES: CS(O)(=O)=O.CN1[C@@H]2CC[C@@H]1CC(C2)OC(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 3246155 |
|---|---|
| CAS | 132-17-2 |
| Molecular Weight (g/mol) | 403.54 |
| MDL Number | MFCD00074784 |
| SMILES | CS(O)(=O)=O.CN1[C@@H]2CC[C@@H]1CC(C2)OC(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | benztropine mesylate,cogentin,benztropine mesilate,benztropine methanesulfonate,unii-wmj8tl7510,benztropine methylsulfonate,benzatropine mesilate,benzatropine mesylate,benzotropine mesylate,cobrentin methanesulfonate |
| InChI Key | CPFJLLXFNPCTDW-STYNFMPRSA-N |
| Molecular Formula | C22H29NO4S |
Basic fuchsin hydrochloride, 99%, For HPLC analysis, MP Biomedicals™
CAS: 569-61-9 Molecular Formula: C19H18ClN3 Molecular Weight (g/mol): 323.824 InChI Key: JUQPZRLQQYSMEQ-UHFFFAOYSA-N Synonym: basic red 9,pararosaniline hydrochloride,parafuchsin,pararosaniline chloride,parafuchsine,p-fuchsin,basic fuchsin,ci basic red 9,c.i. basic red 9,parafuksin PubChem CID: 11292 ChEBI: CHEBI:87663 IUPAC Name: 4-[(4-aminophenyl)-(4-iminocyclohexa-2,5-dien-1-ylidene)methyl]aniline;hydrochloride SMILES: C1=CC(=N)C=CC1=C(C2=CC=C(C=C2)N)C3=CC=C(C=C3)N.Cl
| PubChem CID | 11292 |
|---|---|
| CAS | 569-61-9 |
| Molecular Weight (g/mol) | 323.824 |
| ChEBI | CHEBI:87663 |
| SMILES | C1=CC(=N)C=CC1=C(C2=CC=C(C=C2)N)C3=CC=C(C=C3)N.Cl |
| Synonym | basic red 9,pararosaniline hydrochloride,parafuchsin,pararosaniline chloride,parafuchsine,p-fuchsin,basic fuchsin,ci basic red 9,c.i. basic red 9,parafuksin |
| IUPAC Name | 4-[(4-aminophenyl)-(4-iminocyclohexa-2,5-dien-1-ylidene)methyl]aniline;hydrochloride |
| InChI Key | JUQPZRLQQYSMEQ-UHFFFAOYSA-N |
| Molecular Formula | C19H18ClN3 |
Diphenylmethanol, British Pharmacopoeia (BP) Reference Standard, MilliporeSigma™ Supelco™
This product is provided as delivered and specified by the issuing Pharmacopoeia. All information provided in support of this product, including SDS and any product information leaflets, has been developed and issued under the Authority of the issuing Pharmacopoeia.
Bromothymol blue sodium salt, MP Biomedicals™
CAS: 34722-90-2 Molecular Formula: C27H27Br2NaO5S Molecular Weight (g/mol): 646.37 MDL Number: MFCD00077263,MFCD00077263,MFCD00077263 InChI Key: NMKFVGALBGZKGW-FKWCIMQXSA-M Synonym: cfn0fbc3yh,unii-cfn0fbc3yh,sodium bromothymol blue,bromothymol blue sodium salt,3',3-dibromothymolsulfonephthalein sodium salt,bromthymol blue sodium,phenol, 4,4'-1,1-dioxido-3h-2,1-benzoxathiol-3-ylidene bis 2-bromo-3-methyl-6-1-methylethyl-, monosodium salt,phenol, 4,4'-1,1-dioxido-3h-2,1-benzoxathiol-3-ylidene bis 2-bromo-3-methyl-6-1-methylethyl-, sodium salt 1:1,bromthymol blue sodium salt,bromothymol blue, sodium salt PubChem CID: 102183223 IUPAC Name: sodium 2-{[(1Z)-3-bromo-2-methyl-4-oxo-5-(propan-2-yl)cyclohexa-2,5-dien-1-ylidene][3-bromo-4-hydroxy-2-methyl-5-(propan-2-yl)phenyl]methyl}benzene-1-sulfonate SMILES: [Na+].CC(C)C1=CC(\C(C2=CC=CC=C2S([O-])(=O)=O)=C2/C=C(C(C)C)C(=O)C(Br)=C2C)=C(C)C(Br)=C1O
| PubChem CID | 102183223 |
|---|---|
| CAS | 34722-90-2 |
| Molecular Weight (g/mol) | 646.37 |
| MDL Number | MFCD00077263,MFCD00077263,MFCD00077263 |
| SMILES | [Na+].CC(C)C1=CC(\C(C2=CC=CC=C2S([O-])(=O)=O)=C2/C=C(C(C)C)C(=O)C(Br)=C2C)=C(C)C(Br)=C1O |
| Synonym | cfn0fbc3yh,unii-cfn0fbc3yh,sodium bromothymol blue,bromothymol blue sodium salt,3',3-dibromothymolsulfonephthalein sodium salt,bromthymol blue sodium,phenol, 4,4'-1,1-dioxido-3h-2,1-benzoxathiol-3-ylidene bis 2-bromo-3-methyl-6-1-methylethyl-, monosodium salt,phenol, 4,4'-1,1-dioxido-3h-2,1-benzoxathiol-3-ylidene bis 2-bromo-3-methyl-6-1-methylethyl-, sodium salt 1:1,bromthymol blue sodium salt,bromothymol blue, sodium salt |
| IUPAC Name | sodium 2-{[(1Z)-3-bromo-2-methyl-4-oxo-5-(propan-2-yl)cyclohexa-2,5-dien-1-ylidene][3-bromo-4-hydroxy-2-methyl-5-(propan-2-yl)phenyl]methyl}benzene-1-sulfonate |
| InChI Key | NMKFVGALBGZKGW-FKWCIMQXSA-M |
| Molecular Formula | C27H27Br2NaO5S |
Thermo Scientific Chemicals Pimozide
CAS: 2062-78-4 Molecular Formula: C28H29F2N3O Molecular Weight (g/mol): 461.56 MDL Number: MFCD00055081 InChI Key: YVUQSNJEYSNKRX-UHFFFAOYSA-N IUPAC Name: 1-{1-[4,4-bis(4-fluorophenyl)butyl]piperidin-4-yl}-2,3-dihydro-1H-1,3-benzodiazol-2-one SMILES: FC1=CC=C(C=C1)C(CCCN1CCC(CC1)N1C(=O)NC2=CC=CC=C12)C1=CC=C(F)C=C1
| CAS | 2062-78-4 |
|---|---|
| Molecular Weight (g/mol) | 461.56 |
| MDL Number | MFCD00055081 |
| SMILES | FC1=CC=C(C=C1)C(CCCN1CCC(CC1)N1C(=O)NC2=CC=CC=C12)C1=CC=C(F)C=C1 |
| IUPAC Name | 1-{1-[4,4-bis(4-fluorophenyl)butyl]piperidin-4-yl}-2,3-dihydro-1H-1,3-benzodiazol-2-one |
| InChI Key | YVUQSNJEYSNKRX-UHFFFAOYSA-N |
| Molecular Formula | C28H29F2N3O |
2,6-dibromo-3-chloro-4-fluoroaniline, Thermo Scientific™
CAS: 175135-09-8 Molecular Formula: C6H3Br2ClFN Molecular Weight (g/mol): 303.353 InChI Key: PRZBEZGEEPNKRO-UHFFFAOYSA-N PubChem CID: 2736480 IUPAC Name: 2,6-dibromo-3-chloro-4-fluoroaniline SMILES: C1=C(C(=C(C(=C1Br)N)Br)Cl)F
| PubChem CID | 2736480 |
|---|---|
| CAS | 175135-09-8 |
| Molecular Weight (g/mol) | 303.353 |
| SMILES | C1=C(C(=C(C(=C1Br)N)Br)Cl)F |
| IUPAC Name | 2,6-dibromo-3-chloro-4-fluoroaniline |
| InChI Key | PRZBEZGEEPNKRO-UHFFFAOYSA-N |
| Molecular Formula | C6H3Br2ClFN |
1-(4-Methoxyphenyl)-5-methyl-1H-pyrazole-4-carboxylic acid, 97%, Thermo Scientific™
CAS: 187998-64-7 Molecular Formula: C12H12N2O3 Molecular Weight (g/mol): 232.239 MDL Number: MFCD02677745 InChI Key: JPFGKGZYCXLEGQ-UHFFFAOYSA-N PubChem CID: 2776133 IUPAC Name: 1-(4-methoxyphenyl)-5-methylpyrazole-4-carboxylic acid SMILES: CC1=C(C=NN1C2=CC=C(C=C2)OC)C(=O)O
| PubChem CID | 2776133 |
|---|---|
| CAS | 187998-64-7 |
| Molecular Weight (g/mol) | 232.239 |
| MDL Number | MFCD02677745 |
| SMILES | CC1=C(C=NN1C2=CC=C(C=C2)OC)C(=O)O |
| IUPAC Name | 1-(4-methoxyphenyl)-5-methylpyrazole-4-carboxylic acid |
| InChI Key | JPFGKGZYCXLEGQ-UHFFFAOYSA-N |
| Molecular Formula | C12H12N2O3 |
5-chloro-2-methoxyphenyl isothiocyanate, 97%, Thermo Scientific™
CAS: 63429-99-2 Molecular Formula: C8H6ClNOS Molecular Weight (g/mol): 199.652 MDL Number: MFCD00041073 InChI Key: WGLDKQQXEWPFAR-UHFFFAOYSA-N Synonym: 5-chloro-2-methoxyphenyl isothiocyanate,4-chloro-2-isothiocyanato-1-methoxy-benzene,2-methoxy-5-chlorophenyl isothiocyanate,5-chloro-2-methoxybenzenisothiocyanate,4-chloranyl-2-isothiocyanato-1-methoxy-benzene,acmc-20am4k,4-chloro-2-isothiocyanatoanisole,5-chloro-2-methoxyphenylisothiocyanate,5-chloro-2-methoxyphenyl-isothiocyanate,benzene, 4-chloro-2-isothiocyanato-1-methoxy PubChem CID: 737165 IUPAC Name: 4-chloro-2-isothiocyanato-1-methoxybenzene SMILES: COC1=C(C=C(C=C1)Cl)N=C=S
| PubChem CID | 737165 |
|---|---|
| CAS | 63429-99-2 |
| Molecular Weight (g/mol) | 199.652 |
| MDL Number | MFCD00041073 |
| SMILES | COC1=C(C=C(C=C1)Cl)N=C=S |
| Synonym | 5-chloro-2-methoxyphenyl isothiocyanate,4-chloro-2-isothiocyanato-1-methoxy-benzene,2-methoxy-5-chlorophenyl isothiocyanate,5-chloro-2-methoxybenzenisothiocyanate,4-chloranyl-2-isothiocyanato-1-methoxy-benzene,acmc-20am4k,4-chloro-2-isothiocyanatoanisole,5-chloro-2-methoxyphenylisothiocyanate,5-chloro-2-methoxyphenyl-isothiocyanate,benzene, 4-chloro-2-isothiocyanato-1-methoxy |
| IUPAC Name | 4-chloro-2-isothiocyanato-1-methoxybenzene |
| InChI Key | WGLDKQQXEWPFAR-UHFFFAOYSA-N |
| Molecular Formula | C8H6ClNOS |
sec-Butyl 4-Hydroxybenzoate, Spectrum™ Chemical
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CAS: 17696-61-6
| CAS | 17696-61-6 |
|---|
Methyl 4-aminosalicylate, 97%, Thermo Scientific Chemicals
CAS: 4136-97-4 Molecular Formula: C8H9NO3 Molecular Weight (g/mol): 167.164 MDL Number: MFCD00088091 InChI Key: QQOXBFUTRLDXDP-UHFFFAOYSA-N Synonym: methyl 4-aminosalicylate,methyl p-aminosalicylate,pas methyl ester,p-aminosalicylic acid methyl ester,methyl 4-amino-2-hydroxybenzenecarboxylate,benzoic acid, 4-amino-2-hydroxy-, methyl ester,methyl 4-amino-2-hydroxy-benzoate,salicylic acid, amino-, methyl ester,4-aminosalicylic acid methyl ester,4-amino-2-hydroxy-benzoic acid methyl ester PubChem CID: 77787 ChEBI: CHEBI:35089 IUPAC Name: methyl 4-amino-2-hydroxybenzoate SMILES: COC(=O)C1=C(C=C(C=C1)N)O
| PubChem CID | 77787 |
|---|---|
| CAS | 4136-97-4 |
| Molecular Weight (g/mol) | 167.164 |
| ChEBI | CHEBI:35089 |
| MDL Number | MFCD00088091 |
| SMILES | COC(=O)C1=C(C=C(C=C1)N)O |
| Synonym | methyl 4-aminosalicylate,methyl p-aminosalicylate,pas methyl ester,p-aminosalicylic acid methyl ester,methyl 4-amino-2-hydroxybenzenecarboxylate,benzoic acid, 4-amino-2-hydroxy-, methyl ester,methyl 4-amino-2-hydroxy-benzoate,salicylic acid, amino-, methyl ester,4-aminosalicylic acid methyl ester,4-amino-2-hydroxy-benzoic acid methyl ester |
| IUPAC Name | methyl 4-amino-2-hydroxybenzoate |
| InChI Key | QQOXBFUTRLDXDP-UHFFFAOYSA-N |
| Molecular Formula | C8H9NO3 |
Ethylparaben, NF, 98-102%, Spectrum™ Chemical
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CAS: 120-47-8 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 InChI Key: NUVBSKCKDOMJSU-UHFFFAOYSA-N IUPAC Name: ethyl 4-hydroxybenzoate SMILES: CCOC(=O)C1=CC=C(O)C=C1
| CAS | 120-47-8 |
|---|---|
| Molecular Weight (g/mol) | 166.18 |
| SMILES | CCOC(=O)C1=CC=C(O)C=C1 |
| IUPAC Name | ethyl 4-hydroxybenzoate |
| InChI Key | NUVBSKCKDOMJSU-UHFFFAOYSA-N |
| Molecular Formula | C9H10O3 |
4-(Methanesulfonamido)phenylboronic acid, 97%
CAS: 380430-57-9 Molecular Formula: C7H10BNO4S Molecular Weight (g/mol): 215.03 MDL Number: MFCD02179473 InChI Key: NDVJJEADFLTFCD-UHFFFAOYSA-N Synonym: 4-methylsulfonylamino phenylboronic acid,4-methylsulfonamido phenylboronic acid,4-methanesulfonylaminophenylboronic acid,4-methylsulfonylaminophenylboronic acid,4-methanesulfonylamino phenylboronic acid,4-methylsulfonamido phenyl boronic acid,4-methanesulfonamidophenyl boronic acid,4-methanesulfonamido phenyl boronic acid,4-methylsulphonyl amino benzeneboronic acid,4-methylsulfonylamino benzeneboronic acid PubChem CID: 2773537 IUPAC Name: [4-(methanesulfonamido)phenyl]boronic acid SMILES: CS(=O)(=O)NC1=CC=C(C=C1)B(O)O
| PubChem CID | 2773537 |
|---|---|
| CAS | 380430-57-9 |
| Molecular Weight (g/mol) | 215.03 |
| MDL Number | MFCD02179473 |
| SMILES | CS(=O)(=O)NC1=CC=C(C=C1)B(O)O |
| Synonym | 4-methylsulfonylamino phenylboronic acid,4-methylsulfonamido phenylboronic acid,4-methanesulfonylaminophenylboronic acid,4-methylsulfonylaminophenylboronic acid,4-methanesulfonylamino phenylboronic acid,4-methylsulfonamido phenyl boronic acid,4-methanesulfonamidophenyl boronic acid,4-methanesulfonamido phenyl boronic acid,4-methylsulphonyl amino benzeneboronic acid,4-methylsulfonylamino benzeneboronic acid |
| IUPAC Name | [4-(methanesulfonamido)phenyl]boronic acid |
| InChI Key | NDVJJEADFLTFCD-UHFFFAOYSA-N |
| Molecular Formula | C7H10BNO4S |
N-Methyl-4-(phenoxymethyl)benzylamine, 95%, Thermo Scientific™
CAS: 941716-90-1 Molecular Formula: C15H17NO Molecular Weight (g/mol): 227.31 MDL Number: MFCD09879942 InChI Key: PSMWUOSOWNRPOJ-UHFFFAOYSA-N Synonym: n-methyl-4-phenoxymethyl benzylamine,methyl 4-phenoxymethyl phenyl methyl amine,n-methyl-1-4-phenoxymethyl phenyl methanamine PubChem CID: 24229704 SMILES: CNCC1=CC=C(COC2=CC=CC=C2)C=C1
| PubChem CID | 24229704 |
|---|---|
| CAS | 941716-90-1 |
| Molecular Weight (g/mol) | 227.31 |
| MDL Number | MFCD09879942 |
| SMILES | CNCC1=CC=C(COC2=CC=CC=C2)C=C1 |
| Synonym | n-methyl-4-phenoxymethyl benzylamine,methyl 4-phenoxymethyl phenyl methyl amine,n-methyl-1-4-phenoxymethyl phenyl methanamine |
| InChI Key | PSMWUOSOWNRPOJ-UHFFFAOYSA-N |
| Molecular Formula | C15H17NO |
1-(3-Bromobenzyl)-4-methylperhydro-1,4-diazepine, 97%, Thermo Scientific™
CAS: 414885-80-6 Molecular Formula: C13H19BrN2 Molecular Weight (g/mol): 283.21 MDL Number: MFCD00811036 InChI Key: XUIRKBKKWOVRIJ-UHFFFAOYSA-N Synonym: 1-3-bromobenzyl-4-methylperhydro-1,4-diazepine,1-3-bromophenyl methyl-4-methyl-1,4-diazepane,1-3-bromobenzyl-4-methylhomopiperazine,1h-1,4-diazepine,1-3-bromophenyl methyl hexahydro-4-methyl,1-3-bromobenzyl-4-methyl-1,4-diazepane,cambridge id 5266396 PubChem CID: 764720 IUPAC Name: 1-[(3-bromophenyl)methyl]-4-methyl-1,4-diazepane SMILES: CN1CCCN(CC2=CC(Br)=CC=C2)CC1
| PubChem CID | 764720 |
|---|---|
| CAS | 414885-80-6 |
| Molecular Weight (g/mol) | 283.21 |
| MDL Number | MFCD00811036 |
| SMILES | CN1CCCN(CC2=CC(Br)=CC=C2)CC1 |
| Synonym | 1-3-bromobenzyl-4-methylperhydro-1,4-diazepine,1-3-bromophenyl methyl-4-methyl-1,4-diazepane,1-3-bromobenzyl-4-methylhomopiperazine,1h-1,4-diazepine,1-3-bromophenyl methyl hexahydro-4-methyl,1-3-bromobenzyl-4-methyl-1,4-diazepane,cambridge id 5266396 |
| IUPAC Name | 1-[(3-bromophenyl)methyl]-4-methyl-1,4-diazepane |
| InChI Key | XUIRKBKKWOVRIJ-UHFFFAOYSA-N |
| Molecular Formula | C13H19BrN2 |