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Chlorfenvinphos

CAT: 0572-TRC-C324360-100MGSize: 100 mgDry Ice: NoHazardous: Yes
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CAT#:0572-TRC-C324360-100MGSize:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
470-90-6
Hazard Statement
Fatal if swallowed; UN number: UN3018; Packing Group: I
Purity
>95% (HPLC)
Smiles
CCOP(=O)(OCC)OC(=CCl)c1ccc(Cl)cc1Cl
Molecular Formula
C12 H14 Cl3 O4 P
Molecular Weight
359.57
InChI
InChI=1S/C12H14Cl3O4P/c1-3-17-20(16,18-4-2)19-12(8-13)10-6-5-9(14)7-11(10)15/h5-8H,3-4H2,1-2H3
Additionnal Information
IUPAC name: [2-chloro-1-(2,4-dichlorophenyl)ethenyl] diethyl phosphate
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

Chlorfenvinphos

Chlorfenvinphos is an insecticide that is a colorless liquid with a mild odor. It was commonly used until 1991 when all products containing chlorfenvinphos as an active ingredient were canceled in the United States. Commercial preparations commonly sold in stores were usually 90% chlorfenvinphos. Most of the chlorfenvinphos used was in liquid form. Chlorfenvinphos was widely used to control household pests such as flies, fleas, and mice. The chemical is manufactured and does not occur naturally in the environment. It was sold under common trade names including Birlane®, Dermaton®, Sapercon®, Steladone®, and Supona®. Use of trade names is for identification only and does not imply endorsement by the Agency for Toxic Substances and Disease Registry, the Public Health Service, or the U.S. Department of Health and Human Services.

CAS Number470-90-6
PubChem CID10107
IUPAC Name[2-chloro-1-(2,4-dichlorophenyl)ethenyl] diethyl phosphate
Molecular FormulaC12H14Cl3O4P
Molecular Weight359.6
XLogP3.1
Topological Polar Surface Area44.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count7
Heavy Atom Count20
Formal Charge0
Complexity368
SMILES
CCOP(=O)(OCC)OC(=CCl)C1=C(C=C(C=C1)Cl)Cl
InChI
InChI=1S/C12H14Cl3O4P/c1-3-17-20(16,18-4-2)19-12(8-13)10-6-5-9(14)7-11(10)15/h5-8H,3-4H2,1-2H3
InChIKey
FSAVDKDHPDSCTO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Chlorfenvinphos
CAS: 470-90-6
CID: 10107
Formula: C12H14Cl3O4P
MW: 359.6
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight359.6
XLogP33.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count7
Exact Mass357.969529
Monoisotopic Mass357.969529
Topological Polar Surface Area44.8 Ų
Heavy Atom Count20
Formal Charge0
Complexity368
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count1
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes