Products 85582-63-4

CAS 85582-63-4 appears in our catalog under these names: S-3-Fluorobenzyl ethanethioate, 95%, 95%, Thioacetic acid S-(3-fluoro-benzyl) ester, 95%. Offered by: Chemat, Fluorochem. Available pack sizes: 100mg, 250mg.

S-3-Fluorobenzyl ethanethioate, 95%, 95%
Chemat
  • size: 100mg, 250mg
  • Variants: 2
from 477.20
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Thioacetic acid S-(3-fluoro-benzyl) ester, 95%
Fluorochem
  • size: 100mg, 250mg
  • Variants: 2
from 789.32
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Structural formula: {0} (CAS {1})

S-[(3-fluorophenyl)methyl] ethanethioate (CAS 85582-63-4) is a chemical compound with the molecular formula C9H9FOS and a molecular weight of 184.23 g/mol. IUPAC name: S-[(3-fluorophenyl)methyl] ethanethioate. InChIKey: OPTDNRJVRLGQQR-UHFFFAOYSA-N.

Identity
Molecular formulaC9H9FOS
Molecular weight184.23 g/mol
IUPAC nameS-[(3-fluorophenyl)methyl] ethanethioate
InChIKeyOPTDNRJVRLGQQR-UHFFFAOYSA-N
SMILESCC(=O)SCC1=CC(=CC=C1)F

Computed by PubChem (NCBI)

Synonyms: S-3-Fluorobenzyl ethanethioate, Thioacetic acid S-(3-fluoro-benzyl) ester, S-[(3-fluorophenyl)methyl] ethanethioate, S-(3-fluorobenzyl) ethanethioate, S-3-Fluorobenzylethanethioate
Isomers (same molecular formula)
3-fluoro-4-methyl-2-methylsulfanylbenzaldehyde C9H9FOS
1-(4-fluorophenyl)sulfanylpropan-2-one C9H9FOS
2-fluoro-4-methyl-5-methylsulfanylbenzaldehyde C9H9FOS
S-[(2-fluorophenyl)methyl] ethanethioate C9H9FOS
5-fluoro-2-methyl-3-methylsulfanylbenzaldehyde C9H9FOS
2-fluoro-5-methyl-3-methylsulfanylbenzaldehyde C9H9FOS
4-fluoro-2-methyl-5-methylsulfanylbenzaldehyde C9H9FOS