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Dimethyl Chlorothiophosphate (>85%)

CAT: 0572-TRC-D473290-1GSize: 1 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-D473290-1GSize:1 g
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CAS Number
2524-03-0
Synonyms
Phosphorochloridothioic Acid O,O-Dimethyl Ester; Methyl Phosphorochloridothioate ((MeO)2ClPS) (6CI,7CI); Chlorodimethoxyphosphine Sulfide; Dimethoxy Thiophosphonyl Chloride; Dimethyl Chlorophosphorothioate; Dimethyl Thionophosphorochloridate; Dimethyl Thiophosphorochloridate; NSC 132984; O,O-Dimethyl Chlorophosphorothioate; O,O-Dimethyl Chlorothionophosphate; O,O-Dimethyl Chlorothiophosphate; O,O-Dimethyl Phosphorochloridothioate; O,O-Dimethyl Phosphorochlorothioate; O,O-Dimethyl Phosphorothionochloridate; O,O-Dimethyl Thionophosphorochloridate; O,O-Dimethyl Thiophosphoric Acid Chloride; O,O-Dimethyl Thiophosphoryl Chloride; O,O-Dimethylthionophosphoryl Chloride
Hazard Statement
Harmful if swallowed; UN number: UN2267; Packing Group: II
Smiles
COP(=S)(Cl)OC
Molecular Formula
C2 H6 Cl O2 P S
Molecular Weight
160.56
InChI
InChI=1S/C2H6ClO2PS/c1-4-6(3,7)5-2/h1-2H3
Additionnal Information
IUPAC name: chloro-dimethoxy-sulfanylidene-λ^{5}-phosphane
Shipping Conditions
Ice Packs
Storage Conditions
+4°C

Chemical Information

Dimethyl phosphorochloridothionate

Dimethyl chlorothiophosphate is a colorless to light amber liquid. Used as a chemical intermediate for insecticides, pesticides, and fungicides; oil and gasoline additives; plasticizers; corrosion inhibitors; flame retardants; and flotation agents. Not registered as a pesticide in the U.S. (EPA, 1998)

CAS Number2524-03-0
PubChem CID17304
IUPAC Namechloro-dimethoxy-sulfanylidene-lambda5-phosphane
Molecular FormulaC2H6ClO2PS
Molecular Weight160.56
XLogP2
Topological Polar Surface Area50.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count7
Formal Charge0
Complexity87
SMILES
COP(=S)(OC)Cl
InChI
InChI=1S/C2H6ClO2PS/c1-4-6(3,7)5-2/h1-2H3
InChIKey
XFBJRFNXPUCPKU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Dimethyl phosphorochloridothionate
CAS: 2524-03-0
CID: 17304
Formula: C2H6ClO2PS
MW: 160.56
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight160.56
XLogP32
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass159.9514653
Monoisotopic Mass159.9514653
Topological Polar Surface Area50.6 Ų
Heavy Atom Count7
Formal Charge0
Complexity87.7
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes