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(Z)-Chlorfenvinphos

CAT: 0572-TRC-C324355-25MGSize: 25 mgDry Ice: NoHazardous: Yes
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CAT#:0572-TRC-C324355-25MGSize:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
18708-87-7
Hazard Statement
Fatal if swallowed; UN number: UN3018; Packing Group: I
Smiles
CCOP(=O)(OCC)O\C(=C/Cl)\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/b12-8-
Additionnal Information
IUPAC name: [(Z)-2-chloro-1-(2,4-dichlorophenyl)ethenyl] diethyl phosphate
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

cis-Chlorfenvinphos
CAS Number18708-87-7
PubChem CID5377784
IUPAC Name[(Z)-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)O/C(=C\Cl)/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/b12-8-
InChIKey
FSAVDKDHPDSCTO-WQLSENKSSA-N
Chemical Structure
2D Structure
2D structure of cis-Chlorfenvinphos
CAS: 18708-87-7
CID: 5377784
Formula: C12H14Cl3O4P
MW: 359.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
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 Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
469109-01(Z) -Chlorfenvinphos
AR-C07131-01(Z) -Chlorfenvinphos-d10
AR-C07128-01Chlorfenvinphos-d10 (E/Z Mixture)
AR-C07132-01Chlorfenvinphos (Mixture of Z and E Isomers)
sc-239500Chlorfenvinphos
444334-01Chlorfenvinphos (Z/E ~ 1/2) (E Major)
AR-C07130-01(E) -Chlorfenvinphos
444335-01Chlorfenvinphos-D10 (Z/E ~ 1/2) (E Major)
CS-T-11032Chlorfenvinphos [Mixture of isomers]
RG-A260747-01Chlorfenvinphos (controlled substance)

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