5-tert-Butyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylic acid, 95%

cas: 126231-22-9 — see every product listed under this CAS number, including other names

5-tert-Butyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylic acid, 95% (CAS 126231-22-9) is a chemical reagent available from Chemat. Available pack sizes: 1g, 5g. Offered by: Combi-blocks.

• 2D
• 3D

5-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylic acid (CAS 126231-22-9) is a chemical compound with the molecular formula C13H18O2S and a molecular weight of 238.35 g/mol. IUPAC name: 5-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylic acid. InChIKey: VDSYCTWGBTXSEX-UHFFFAOYSA-N.

Identity

Molecular formula	C13H18O2S
Molecular weight	238.35 g/mol
IUPAC name	5-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylic acid
InChIKey	VDSYCTWGBTXSEX-UHFFFAOYSA-N
SMILES	CC(C)(C)C1CCC2=C(C1)C=C(S2)C(=O)O

Computed by PubChem (NCBI)

Synonyms: 5-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylic acid, 5-(tert-butyl)-4,5,6,7-tetrahydrobenzo[b]thiophene-2-carboxylic acid, Oprea1_124923, Benzo[b]thiophene-2-carboxylic acid, 5-(1,1-dimethylethyl)-4,5,6,7-tetrahydro-, 5-tert-butyl-4,5,6,7-tetrahydrobenzothiophene-2-carboxylic Acid, 5-tert-butyltetrahydrobenzothiophene-2-carboxylic acid, 5-(tert-Butyl)-4,5,6,7-tetrahydrobenzothiophene-2-carboxylic Acid

Isomers (same molecular formula)

1-[(R)-cyclohexylsulfinyl]-2-methoxybenzene C₁₃H₁₈O₂S

methyl 2-[(4-methylsulfanylphenyl)methyl]butanoate C₁₃H₁₈O₂S

3-methyl-2-[(4-methylsulfanylphenyl)methyl]butanoic acid C₁₃H₁₈O₂S

methyl 2,2-dimethyl-3-(4-methylsulfanylphenyl)propanoate C₁₃H₁₈O₂S

methyl 2,2-dimethyl-3-(2-methylsulfanylphenyl)propanoate C₁₃H₁₈O₂S

methyl 2,2-dimethyl-3-(3-methylsulfanylphenyl)propanoate C₁₃H₁₈O₂S

ethyl 2,2-dimethyl-3-(4-sulfanylphenyl)propanoate C₁₃H₁₈O₂S

2-[(4-tert-butylphenyl)methylsulfanyl]acetic acid C₁₃H₁₈O₂S

tert-butyl 4-methyl-2-methylsulfanylbenzoate C₁₃H₁₈O₂S

4-(4-ethoxyphenyl)thian-4-ol C₁₃H₁₈O₂S

4-(4-ethylsulfanylphenyl)oxan-4-ol C₁₃H₁₈O₂S