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Phosmet

CAT: 1596-AR-P31385-01Size: 10 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-P31385-01Size:10 Units
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CAS Number
732-11-6
Molecular Formula
C11H12NO4PS2
Molecular Weight
317.31
API Name
Phosmet

Chemical Information

Phosmet

Phosmet is an organothiophosphate insecticide, an organic thiophosphate and a member of phthalimides. It has a role as an acaricide, an agrochemical and an EC 3.1.1.7 (acetylcholinesterase) inhibitor. It is functionally related to a N-(hydroxymethyl)phthalimide.

CAS Number732-11-6
PubChem CID12901
IUPAC Name2-(dimethoxyphosphinothioylsulfanylmethyl)isoindole-1,3-dione
Molecular FormulaC11H12NO4PS2
Molecular Weight317.3
XLogP2.8
Topological Polar Surface Area113
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Heavy Atom Count19
Formal Charge0
Complexity399
SMILES
COP(=S)(OC)SCN1C(=O)C2=CC=CC=C2C1=O
InChI
InChI=1S/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3
InChIKey
LMNZTLDVJIUSHT-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Phosmet
CAS: 732-11-6
CID: 12901
Formula: C11H12NO4PS2
MW: 317.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight317.3
XLogP32.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Exact Mass316.99453721
Monoisotopic Mass316.99453721
Topological Polar Surface Area113 Ų
Heavy Atom Count19
Formal Charge0
Complexity399
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

Alternative Products

CatalogName
CS-T-60528Phosmet
HY-W743435-01Phosmet-d6
CS-ZG-91315Phosmet oxon
TRC-P353705-10MGPhosmet-oxon
HY-121745RPhosmet oxon (Standard)
S-4182100 ug/mL Phosmet oxon in Toluene

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