Ethyl bis(ethylthio)acetate (C8H16O2S2)

Ethyl bis(ethylthio)acetate (C8H16O2S2; CAS 20461-95-4) is a practical retrosynthesis target. Ethyl bis(ethylthio)acetate presents a C8 framework. Open AI route search in one click below.

Target: Ethyl bis(ethylthio)acetate
CAS: 20461-95-4
Formula: C8H16O2S2
Approx. MW: 208.33
SMILES: CCOC(=O)C(SCC)SCC
PubChem CID: 88550
Approx. carbons: C8

Ethyl bis(ethylthio)acetate structure

Properties

IUPAC name: ethyl 2,2-bis(ethylsulfanyl)acetate
Common names: Ethyl bis(ethylthio)acetate; 20461-95-4; Glyoxylic acid ethyl ester diethyl mercaptal; 5CND477VD7; EINECS 243-836-3; 2,2-bis(ethylthio)acetic acid ethyl ester; Acetic acid, bis(ethylthio)-, ethyl ester; DTXSID30174425; RefChem:596142; DTXCID2096916
Molecular weight: 208.30
Exact mass: 208.06
InChIKey: DGQHHBMWVOYSHU-UHFFFAOYSA-N

View on PubChem

Ethyl bis(ethylthio)acetate 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of Ethyl bis(ethylthio)acetate?

Ethyl bis(ethylthio)acetate has molecular formula C8H16O2S2. Molecular weight about 208.33 g·mol⁻¹.

What is the CAS number of Ethyl bis(ethylthio)acetate?

The CAS Registry Number for Ethyl bis(ethylthio)acetate is 20461-95-4.

Run AI retrosynthesis for Ethyl bis(ethylthio)acetate Target catalog AI tools overview

Start from this SMILES and explore AI retrosynthesis routes for C8H16O2S2.

References & tools

ChemicalTool Reaction — AI retrosynthesis with optional library evidence.
PubChem — compound identifiers and structure depictions (NIH/NCBI).
Related: AiZynthFinder / synthesis planning literature for computer-aided retrosynthesis.