Products 588714-23-2

CAS 588714-23-2 appears in our catalog under these names: Methyl 2-isothiocyanato-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate, 95%, Methyl 2-isothiocyanato-4,5,6,7,8,9-hexahydrocycloocta(b)thiophene-3-carboxylate, 95%. Offered by: Combi-blocks, AmBeed. Available pack sizes: 250mg, 1g, 5g.

Methyl 2-isothiocyanato-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate, 95%
Combi-blocks
  • size: 250mg, 1g, 5g
  • Variants: 3
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Methyl 2-isothiocyanato-4,5,6,7,8,9-hexahydrocycloocta(b)thiophene-3-carboxylate, 95%
AmBeed
  • size: 5g
  • Variants: 1
from 10225.60
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Structural formula: {0} (CAS {1})

Methyl 2-isothiocyanato-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate (CAS 588714-23-2) is a chemical compound with the molecular formula C13H15NO2S2 and a molecular weight of 281.4 g/mol. IUPAC name: methyl 2-isothiocyanato-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate. InChIKey: RWSOHHLCOWETST-UHFFFAOYSA-N.

Identity
Molecular formulaC13H15NO2S2
Molecular weight281.4 g/mol
IUPAC namemethyl 2-isothiocyanato-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
InChIKeyRWSOHHLCOWETST-UHFFFAOYSA-N
SMILESCOC(=O)C1=C(SC2=C1CCCCCC2)N=C=S

Computed by PubChem (NCBI)

Synonyms: methyl 2-isothiocyanato-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate, methyl 2-isothiocyanato-4H,5H,6H,7H,8H,9H-cycloocta[b]thiophene-3-carboxylate, RWSOHHLCOWETST-UHFFFAOYSA-N, methyl 4,5,6,7,8,9-hexahydro-2-isothiocyanatocycloocta[b]thiophene-3-carboxylate
Isomers (same molecular formula)
tert-butyl 2-amino-4-thiophen-3-ylthiophene-3-carboxylate C13H15NO2S2
tert-butyl 2-amino-4-thiophen-2-ylthiophene-3-carboxylate C13H15NO2S2
ethyl 2-isothiocyanato-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate C13H15NO2S2