O-Butyl methylphosphonochloridothioate structure

O-Butyl methylphosphonochloridothioate

butoxy-chloro-methyl-sulfanylidene-λ5-phosphane

Also Known As: Methylphosphonochloridothioic acid O-butyl ester|O-butyl methylphosphonochloridothioate|O-n-Butyl methylphosphonochloridothioate|butyl methylphosphonothiochloridate|butoxy-chloro-methyl-sulfanylidene-|Quinoline,2,3-dimethyl-,perchlorate|butoxy(chloro)methyl-lambda5-phosphanethione|Phosphonochloridothioic acid, methyl-, O-butyl ester|butoxy-chloro-methyl-sulfanylidene-lambda5-phosphane

CAS: 18005-38-4
Molecular Formula C5H12ClOPS
Molecular Weight 186.0035 g/mol
LogP 3.2
Topological Polar Surface Area 41.3 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 2
Rotatable Bonds 4
Exact Mass 186.0035
Monoisotopic Mass 186.0035
Heavy Atoms 9
Complexity 118.0

Chemical Identifiers

CAS Number 18005-38-4
SMILES CCCCOP(=S)(C)Cl
InChIKey RGAHUIUUJNOBEF-UHFFFAOYSA-N

Product Overview

O-Butyl methylphosphonochloridothioate (CAS 18005-38-4), with molecular formula C5H12ClOPS and molecular weight 186.0035 g/mol. IUPAC: butoxy-chloro-methyl-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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