Benzene and substituted derivatives
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Benzene and substituted derivatives
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Fluconazole, USP, 98-102%, Spectrum™ Chemical
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CAS: 86386-73-4 Molecular Formula: C13H12F2N6O Molecular Weight (g/mol): 306.28 InChI Key: RFHAOTPXVQNOHP-UHFFFAOYSA-N IUPAC Name: 2-(2,4-difluorophenyl)-1,3-bis(1H-1,2,4-triazol-1-yl)propan-2-ol SMILES: OC(CN1C=NC=N1)(CN1C=NC=N1)C1=CC=C(F)C=C1F
CAS | 86386-73-4 |
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Molecular Weight (g/mol) | 306.28 |
SMILES | OC(CN1C=NC=N1)(CN1C=NC=N1)C1=CC=C(F)C=C1F |
IUPAC Name | 2-(2,4-difluorophenyl)-1,3-bis(1H-1,2,4-triazol-1-yl)propan-2-ol |
InChI Key | RFHAOTPXVQNOHP-UHFFFAOYSA-N |
Molecular Formula | C13H12F2N6O |
Homosalate, Spectrum™ Chemical
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CAS: 118-56-9 Molecular Formula: C16H22O3 Molecular Weight (g/mol): 262.35 InChI Key: WSSJONWNBBTCMG-UHFFFAOYNA-N IUPAC Name: 3,3,5-trimethylcyclohexyl 2-hydroxybenzoate SMILES: CC1CC(CC(C)(C)C1)OC(=O)C1=CC=CC=C1O
CAS | 118-56-9 |
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Molecular Weight (g/mol) | 262.35 |
SMILES | CC1CC(CC(C)(C)C1)OC(=O)C1=CC=CC=C1O |
IUPAC Name | 3,3,5-trimethylcyclohexyl 2-hydroxybenzoate |
InChI Key | WSSJONWNBBTCMG-UHFFFAOYNA-N |
Molecular Formula | C16H22O3 |
Loperamide Hydrochloride, USP, 98-102%, Spectrum™ Chemical
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CAS: 34552-83-5 Molecular Formula: C29H34Cl2N2O2 Molecular Weight (g/mol): 513.50 InChI Key: PGYPOBZJRVSMDS-UHFFFAOYSA-N IUPAC Name: hydrogen 4-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-N,N-dimethyl-2,2-diphenylbutanamide chloride SMILES: [H+].[Cl-].CN(C)C(=O)C(CCN1CCC(O)(CC1)C1=CC=C(Cl)C=C1)(C1=CC=CC=C1)C1=CC=CC=C1
CAS | 34552-83-5 |
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Molecular Weight (g/mol) | 513.50 |
SMILES | [H+].[Cl-].CN(C)C(=O)C(CCN1CCC(O)(CC1)C1=CC=C(Cl)C=C1)(C1=CC=CC=C1)C1=CC=CC=C1 |
IUPAC Name | hydrogen 4-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-N,N-dimethyl-2,2-diphenylbutanamide chloride |
InChI Key | PGYPOBZJRVSMDS-UHFFFAOYSA-N |
Molecular Formula | C29H34Cl2N2O2 |
Meclizine Hydrochloride, USP, 97-102%, Spectrum™ Chemical
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CAS: 1104-22-9 Molecular Formula: C25H29Cl3N2 Molecular Weight (g/mol): 463.87 InChI Key: VCTHNOIYJIXQLV-UHFFFAOYNA-N IUPAC Name: dihydrogen 1-[(4-chlorophenyl)(phenyl)methyl]-4-[(3-methylphenyl)methyl]piperazine dichloride SMILES: [H+].[H+].[Cl-].[Cl-].CC1=CC=CC(CN2CCN(CC2)C(C2=CC=CC=C2)C2=CC=C(Cl)C=C2)=C1
CAS | 1104-22-9 |
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Molecular Weight (g/mol) | 463.87 |
SMILES | [H+].[H+].[Cl-].[Cl-].CC1=CC=CC(CN2CCN(CC2)C(C2=CC=CC=C2)C2=CC=C(Cl)C=C2)=C1 |
IUPAC Name | dihydrogen 1-[(4-chlorophenyl)(phenyl)methyl]-4-[(3-methylphenyl)methyl]piperazine dichloride |
InChI Key | VCTHNOIYJIXQLV-UHFFFAOYNA-N |
Molecular Formula | C25H29Cl3N2 |
Benzocaine, USP, 98-102%, Spectrum™ Chemical
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CAS: 94-09-7 Molecular Formula: C9H11NO2 Molecular Weight (g/mol): 165.19 MDL Number: MFCD00007892 InChI Key: BLFLLBZGZJTVJG-UHFFFAOYSA-N IUPAC Name: ethyl 4-aminobenzoate SMILES: CCOC(=O)C1=CC=C(N)C=C1
CAS | 94-09-7 |
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Molecular Weight (g/mol) | 165.19 |
MDL Number | MFCD00007892 |
SMILES | CCOC(=O)C1=CC=C(N)C=C1 |
IUPAC Name | ethyl 4-aminobenzoate |
InChI Key | BLFLLBZGZJTVJG-UHFFFAOYSA-N |
Molecular Formula | C9H11NO2 |
Methyl Salicylate, NF, 98-102%, Spectrum™ Chemical
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CAS: 119-36-8 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.15 InChI Key: OSWPMRLSEDHDFF-UHFFFAOYSA-N IUPAC Name: methyl 2-hydroxybenzoate SMILES: COC(=O)C1=CC=CC=C1O
CAS | 119-36-8 |
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Molecular Weight (g/mol) | 152.15 |
SMILES | COC(=O)C1=CC=CC=C1O |
IUPAC Name | methyl 2-hydroxybenzoate |
InChI Key | OSWPMRLSEDHDFF-UHFFFAOYSA-N |
Molecular Formula | C8H8O3 |
Mefenamic Acid, BP, 99-101%, Spectrum™ Chemical
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CAS: 61-68-7 Molecular Formula: C15H15NO2 Molecular Weight (g/mol): 241.29 InChI Key: HYYBABOKPJLUIN-UHFFFAOYSA-N IUPAC Name: 2-[(2,3-dimethylphenyl)amino]benzoic acid SMILES: CC1=CC=CC(NC2=CC=CC=C2C(O)=O)=C1C
CAS | 61-68-7 |
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Molecular Weight (g/mol) | 241.29 |
SMILES | CC1=CC=CC(NC2=CC=CC=C2C(O)=O)=C1C |
IUPAC Name | 2-[(2,3-dimethylphenyl)amino]benzoic acid |
InChI Key | HYYBABOKPJLUIN-UHFFFAOYSA-N |
Molecular Formula | C15H15NO2 |
Methylparaben Sodium, NF, 95-102%, Spectrum™ Chemical
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CAS: 5026-62-0 Molecular Formula: C8H7NaO3 Molecular Weight (g/mol): 174.13 InChI Key: PESXGULMKCKJCC-UHFFFAOYSA-M IUPAC Name: sodium 4-(methoxycarbonyl)benzen-1-olate SMILES: [Na+].COC(=O)C1=CC=C([O-])C=C1
CAS | 5026-62-0 |
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Molecular Weight (g/mol) | 174.13 |
SMILES | [Na+].COC(=O)C1=CC=C([O-])C=C1 |
IUPAC Name | sodium 4-(methoxycarbonyl)benzen-1-olate |
InChI Key | PESXGULMKCKJCC-UHFFFAOYSA-M |
Molecular Formula | C8H7NaO3 |
Octocrylene, 95%, Spectrum™ Chemical
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CAS: 6197-30-4 Molecular Formula: C24H27NO2 Molecular Weight (g/mol): 361.49 MDL Number: MFCD00059260 InChI Key: FMJSMJQBSVNSBF-UHFFFAOYNA-N IUPAC Name: 2-ethylhexyl 2-cyano-3,3-diphenylprop-2-enoate SMILES: CCCCC(CC)COC(=O)C(C#N)=C(C1=CC=CC=C1)C1=CC=CC=C1
CAS | 6197-30-4 |
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Molecular Weight (g/mol) | 361.49 |
MDL Number | MFCD00059260 |
SMILES | CCCCC(CC)COC(=O)C(C#N)=C(C1=CC=CC=C1)C1=CC=CC=C1 |
IUPAC Name | 2-ethylhexyl 2-cyano-3,3-diphenylprop-2-enoate |
InChI Key | FMJSMJQBSVNSBF-UHFFFAOYNA-N |
Molecular Formula | C24H27NO2 |
Triclosan, USP, 97-103%, Spectrum™ Chemical
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CAS: 3380-34-5 Molecular Formula: C12H7Cl3O2 Molecular Weight (g/mol): 289.54 InChI Key: XEFQLINVKFYRCS-UHFFFAOYSA-N IUPAC Name: 5-chloro-2-(2,4-dichlorophenoxy)phenol SMILES: OC1=CC(Cl)=CC=C1OC1=CC=C(Cl)C=C1Cl
CAS | 3380-34-5 |
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Molecular Weight (g/mol) | 289.54 |
SMILES | OC1=CC(Cl)=CC=C1OC1=CC=C(Cl)C=C1Cl |
IUPAC Name | 5-chloro-2-(2,4-dichlorophenoxy)phenol |
InChI Key | XEFQLINVKFYRCS-UHFFFAOYSA-N |
Molecular Formula | C12H7Cl3O2 |
Verapamil Hydrochloride, USP, 98-102%, Spectrum™ Chemical
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CAS: 152-11-4 Molecular Formula: C27H39ClN2O4 Molecular Weight (g/mol): 491.07 InChI Key: DOQPXTMNIUCOSY-UHFFFAOYNA-N IUPAC Name: hydrogen 2-(3,4-dimethoxyphenyl)-5-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-2-(propan-2-yl)pentanenitrile chloride SMILES: [H+].[Cl-].COC1=CC=C(CCN(C)CCCC(C#N)(C(C)C)C2=CC=C(OC)C(OC)=C2)C=C1OC
CAS | 152-11-4 |
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Molecular Weight (g/mol) | 491.07 |
SMILES | [H+].[Cl-].COC1=CC=C(CCN(C)CCCC(C#N)(C(C)C)C2=CC=C(OC)C(OC)=C2)C=C1OC |
IUPAC Name | hydrogen 2-(3,4-dimethoxyphenyl)-5-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-2-(propan-2-yl)pentanenitrile chloride |
InChI Key | DOQPXTMNIUCOSY-UHFFFAOYNA-N |
Molecular Formula | C27H39ClN2O4 |
Benzyl Alcohol, ACS, 99%, Spectrum™ Chemical
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CAS: 100-51-6 Molecular Formula: C7H8O Molecular Weight (g/mol): 108.14 InChI Key: WVDDGKGOMKODPV-UHFFFAOYSA-N IUPAC Name: phenylmethanol SMILES: OCC1=CC=CC=C1
CAS | 100-51-6 |
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Molecular Weight (g/mol) | 108.14 |
SMILES | OCC1=CC=CC=C1 |
IUPAC Name | phenylmethanol |
InChI Key | WVDDGKGOMKODPV-UHFFFAOYSA-N |
Molecular Formula | C7H8O |
Dowtherm(R) SR-1, Spectrum™ Chemical
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CAS | 7758-11-4 |
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Grade | Reagent |
Sulfanilic Acid, Anhydrous, ACS, 98-102%, Spectrum™ Chemical
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CAS: 121-57-3 Molecular Formula: C6H7NO3S Molecular Weight (g/mol): 173.19 InChI Key: HVBSAKJJOYLTQU-UHFFFAOYSA-N IUPAC Name: 4-aminobenzene-1-sulfonic acid SMILES: NC1=CC=C(C=C1)S(O)(=O)=O
CAS | 121-57-3 |
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Molecular Weight (g/mol) | 173.19 |
SMILES | NC1=CC=C(C=C1)S(O)(=O)=O |
IUPAC Name | 4-aminobenzene-1-sulfonic acid |
InChI Key | HVBSAKJJOYLTQU-UHFFFAOYSA-N |
Molecular Formula | C6H7NO3S |
2-Ethoxybenzoic Acid, Spectrum™ Chemical
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CAS: 134-11-2
CAS | 134-11-2 |
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