Products 588713-28-4

CAS 588713-28-4 is the registry number for Methyl 2-isothiocyanato-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, 95%. Offered by: Combi-blocks, AmBeed. Available pack sizes: 5g, 250mg, 1g.

Methyl 2-isothiocyanato-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, 95%
Combi-blocks, AmBeed
  • size: 5g, 250mg, 1g
  • Variants: 4
from 10225.60
View product
Structural formula: {0} (CAS {1})

Methyl 2-isothiocyanato-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate (CAS 588713-28-4) is a chemical compound with the molecular formula C12H13NO2S2 and a molecular weight of 267.4 g/mol. IUPAC name: methyl 2-isothiocyanato-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate. InChIKey: HMLSGWSAVOKQNI-UHFFFAOYSA-N.

Identity
Molecular formulaC12H13NO2S2
Molecular weight267.4 g/mol
IUPAC namemethyl 2-isothiocyanato-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
InChIKeyHMLSGWSAVOKQNI-UHFFFAOYSA-N
SMILESCC1CCC2=C(C1)SC(=C2C(=O)OC)N=C=S

Computed by PubChem (NCBI)

Synonyms: HMLSGWSAVOKQNI-UHFFFAOYSA-N, Methyl 2-isothiocyanato-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate
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
methyl 2-isothiocyanato-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate C12H13NO2S2
ethyl 2-isothiocyanato-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