Phosphorothioic acid, O,O-diethyl S-heptyl ester structure

Phosphorothioic acid, O,O-diethyl S-heptyl ester

diethoxy-heptan-2-yloxy-sulfanylidene-λ5-phosphane

Also Known As: O,O-Diethyl S-heptyl phosphorothioate|o,o-diethyl o-heptan-2-yl phosphorothioate|diethoxy-heptan-2-yloxy-sulfanylidene-|Phosphorothioic acid, O,O-diethyl S-heptyl ester|O,O-Diethyl O-(heptan-2-yl) phosphorothioate

CAS: 6324-49-8
Molecular Formula C11H25O3PS
Molecular Weight 268.1262 g/mol
LogP 4.7
Topological Polar Surface Area 59.8 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 4
Rotatable Bonds 10
Exact Mass 268.1262
Monoisotopic Mass 268.1262
Heavy Atoms 16
Complexity 201.0

Chemical Identifiers

CAS Number 6324-49-8
SMILES CCCCCC(C)OP(=S)(OCC)OCC
InChIKey NETWHEUXGRBSSI-UHFFFAOYSA-N

Product Overview

Phosphorothioic acid, O,O-diethyl S-heptyl ester (CAS 6324-49-8), with molecular formula C11H25O3PS and molecular weight 268.1262 g/mol. IUPAC: diethoxy-heptan-2-yloxy-sulfanylidene-λ5-phosphane.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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