O,S-Dimethyl propylphosphonothioate structure

O,S-Dimethyl propylphosphonothioate

1-[methoxy(methylsulfanyl)phosphoryl]propane

Also Known As: Propylphosphonothioic acid O,S-dimethyl ester|o,S-Dimethyl propylphosphonothioate|o,S-Dimethyl propylphosphonothioate #|Phosphonothioic acid, propyl-, O,S-dimethyl ester|methyl (methylsulfanyl)(propyl)phosphinate|1-[methoxy(methylsulfanyl)phosphoryl]propane|J1.861.387E

CAS: 90220-19-2
Molecular Formula C5H13O2PS
Molecular Weight 168.03738 g/mol
LogP 0.8
Topological Polar Surface Area 51.6 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 3
Rotatable Bonds 4
Exact Mass 168.03738
Monoisotopic Mass 168.03738
Heavy Atoms 9
Complexity 116.0

Chemical Identifiers

CAS Number 90220-19-2
SMILES CCCP(=O)(OC)SC
InChIKey KHDOCIXBNDMHPL-UHFFFAOYSA-N

Patent-Derived Application Labels

Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.

Organic Building Blocks (1 patents) Organometallic Reagents (3 patents)

Product Overview

O,S-Dimethyl propylphosphonothioate (CAS 90220-19-2), with molecular formula C5H13O2PS and molecular weight 168.03738 g/mol. IUPAC: 1-[methoxy(methylsulfanyl)phosphoryl]propane.

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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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