Methyl 2-isothiocyanato-5,6,7,8-tetrahydro-4h-cyclohepta(b)thiophene-3-carboxylate, 95%

cas: 588695-57-2 — see every product listed under this CAS number, including other names

Methyl 2-isothiocyanato-5,6,7,8-tetrahydro-4h-cyclohepta(b)thiophene-3-carboxylate, 95% (CAS 588695-57-2) is a chemical reagent available from Chemat. Available pack sizes: 5g. Offered by: AmBeed.

• 2D
• 3D

Methyl 2-isothiocyanato-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate (CAS 588695-57-2) is a chemical compound with the molecular formula C12H13NO2S2 and a molecular weight of 267.4 g/mol. IUPAC name: methyl 2-isothiocyanato-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate. InChIKey: VNBQHESWEMVAQR-UHFFFAOYSA-N.

Identity

Molecular formula	C12H13NO2S2
Molecular weight	267.4 g/mol
IUPAC name	methyl 2-isothiocyanato-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
InChIKey	VNBQHESWEMVAQR-UHFFFAOYSA-N
SMILES	COC(=O)C1=C(SC2=C1CCCCC2)N=C=S

Computed by PubChem (NCBI)

Synonyms: methyl 2-isothiocyanato-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carboxylate, Oprea1_019935, VNBQHESWEMVAQR-UHFFFAOYSA-N

Isomers (same molecular formula)

6,6-dimethyl-3-methylsulfinyl-4-oxo-5,7-dihydro-2-benzothiophene-1-carbonitrile C₁₂H₁₃NO₂S₂

(4-ethoxyphenyl)-(2-sulfanylidene-1,3-thiazolidin-3-yl)methanone C₁₂H₁₃NO₂S₂

ethyl 2-amino-4-(5-methylthiophen-2-yl)thiophene-3-carboxylate C₁₂H₁₃NO₂S₂

ethyl 2-isothiocyanato-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate C₁₂H₁₃NO₂S₂

methyl 2-isothiocyanato-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate C₁₂H₁₃NO₂S₂

4-methyl-N-(thiophen-2-ylmethyl)benzenesulfonamide C₁₂H₁₃NO₂S₂

2-(1,3-benzothiazol-2-ylsulfanyl)-3-methylbutanoic acid C₁₂H₁₃NO₂S₂

1-[3-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)-4-hydroxyphenyl]ethanone C₁₂H₁₃NO₂S₂

ethyl 2-(3-sulfanylidene-4H-1,4-benzothiazin-2-yl)acetate C₁₂H₁₃NO₂S₂

2-(benzenesulfonyl)-2-thiophen-2-ylethanamine C₁₂H₁₃NO₂S₂