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Dimethoate

CAT: 0572-TRC-D460505-1GSize: 1 gDry Ice: NoHazardous: Yes
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CAT#:0572-TRC-D460505-1GSize:1 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
60-51-5
Synonyms
Phosphorodithioic acid, O,O-dimethyl S-[2-(methylamino)-2-oxoethyl] ester; Phosphorodithioic acid, O,O-dimethyl S-(methylcarbamoylmethyl) ester (6CI); Phosphorodithioic acid, O,O-dimethyl ester, S-ester with 2-mercapto-N-methylacetamide (8CI); 8014 Bis HC; Aadimethoal; Agrithoate 40EC; American Cyanamid 12,880; BI 58; Bi 58 Nowy; Bi 58 Nowy 400EC; CL 12880; Cerox; Chloromezyl; Cygon; Cygon 2E; Cygon 400; Cygon 4E; Cygon Insecticide; Danadim; Daphene; De-fend; Dimate; Dimate (insecticide); Dimethoate; Dimeton; Dimevur; Dimezyl; Dimezyl 400EC; Ditimur 40; Dudu Ethoate; ENT 24650; Experimental Insecticide 12880; FIP; Fosfatox R; Fosfotox; Fosfotox R; Fosfotox R 35; Fostion MM; Laition; Lurgo; O,O-Dimethyl S-(N-methylcarbamoylmethyl) dithiophosphate; O,O-Dimethyl S-(N-methylcarbamoylmethyl) phosphorodithioate; PEI 75; Perfekthion; Perfekthion S; Phosphamid; Phosphamide; Racusan; Rogor; Rogor 20L; Rogor 40; Rogor L; Rogor P; Roxion; S-Methylcarbamoylmethyl O,O-dimethyl phosphorodithioate; Sinoratox; Sistemin; Super Ethoate; Systemin; Systemin (pesticide); Systoate; Tafgor 40EC; Tara; Tara 909; Tiomet
Hazard Statement
Toxic if swallowed; UN number: UN2783; Packing Group: III
Smiles
CNC(=O)CSP(=S)(OC)OC
Molecular Formula
C5 H12 N O3 P S2
Molecular Weight
229.26
InChI
InChI=1S/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)
Additionnal Information
IUPAC name: 2-dimethoxyphosphinothioylsulfanyl-N-methylacetamide
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

Dimethoate

Dimethoate is a monocarboxylic acid amide that is N-methylacetamide in which one of the hydrogens of the methyl group attached to the carbonyl moiety is replaced by a (dimethoxyphosphorothioyl)sulfanediyl group. It has a role as an acaricide, an insecticide, an agrochemical, a xenobiotic, an EC 3.1.1.8 (cholinesterase) inhibitor, an EC 3.1.1.7 (acetylcholinesterase) inhibitor and an environmental contaminant. It is a monocarboxylic acid amide and an organic thiophosphate. It is functionally related to a N-methyl-2-sulfanylacetamide.

CAS Number60-51-5
PubChem CID3082
IUPAC Name2-dimethoxyphosphinothioylsulfanyl-N-methylacetamide
Molecular FormulaC5H12NO3PS2
Molecular Weight229.3
XLogP0.8
Topological Polar Surface Area105
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count12
Formal Charge0
Complexity191
SMILES
CNC(=O)CSP(=S)(OC)OC
InChI
InChI=1S/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)
InChIKey
MCWXGJITAZMZEV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Dimethoate
CAS: 60-51-5
CID: 3082
Formula: C5H12NO3PS2
MW: 229.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight229.3
XLogP30.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass228.99962259
Monoisotopic Mass228.99962259
Topological Polar Surface Area105 Ų
Heavy Atom Count12
Formal Charge0
Complexity191
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

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