RefChem:316401
propan-2-yl 2-(2-diethoxyphosphinothioylsulfanylethylsulfanyl)acetate
Also Known As: Acetic acid, 2-((2-mercaptoethyl)thio)-, isopropyl eseter, S-ester with O,O-diethyl phosphorodithioate|3-Oxa-5,8-dithia-4-phosphadecan-10-oic acid, 4-ethoxy-, 1-methylethyl ester, 4-sulfide|propan-2-yl 2-(2-diethoxyphosphinothioylsulfanylethylsulfanyl)acetate|[2-[(Diethoxyphosphinothioyl)thio]ethylthio]acetic acid isopropyl ester|Propan-2-yl 4-ethoxy-4-sulfanylidene-3-oxa-5,8-dithia-4lambda~5~-phosphadecan-10-oate|propan-2-yl 2-[(2-{[diethoxy(sulfanylidene)-lambda5-phosphanyl]sulfanyl}ethyl)sulfanyl]acetate
| Molecular Formula | C11H23O4PS3 |
|---|---|
| Molecular Weight | 346.04962 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 127.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 12 |
| Exact Mass | 346.04962 |
| Monoisotopic Mass | 346.04962 |
| Heavy Atoms | 19 |
| Complexity | 290.0 |
Chemical Identifiers
| CAS Number | 63233-96-5 |
|---|---|
| SMILES | CCOP(=S)(OCC)SCCSCC(=O)OC(C)C |
| InChIKey | HCGWQUXMVXFGRE-UHFFFAOYSA-N |
Product Overview
RefChem:316401 (CAS 63233-96-5), with molecular formula C11H23O4PS3 and molecular weight 346.04962 g/mol. IUPAC: propan-2-yl 2-(2-diethoxyphosphinothioylsulfanylethylsulfanyl)acetate.
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