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Iodofenphos

CAT: 0931-T24172-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T24172-02Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
18181-70-9
Target
Others
Related Pathways
Others
Bioactivity
Iodofenphos is an obsolete insecticide.
Smiles
S=P(OC=1C=C(Cl)C(I)=CC1Cl)(OC)OC
Molecular Formula
C8H8Cl2IO3PS
Molecular Weight
413
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Iodofenphos

Iodofenphos is an organic thiophosphate.

CAS Number18181-70-9
PubChem CID28935
IUPAC Name(2,5-dichloro-4-iodophenoxy)-dimethoxy-sulfanylidene-lambda5-phosphane
Molecular FormulaC8H8Cl2IO3PS
Molecular Weight413.00
XLogP5.5
Topological Polar Surface Area59.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count16
Formal Charge0
Complexity276
SMILES
COP(=S)(OC)OC1=CC(=C(C=C1Cl)I)Cl
InChI
InChI=1S/C8H8Cl2IO3PS/c1-12-15(16,13-2)14-8-4-5(9)7(11)3-6(8)10/h3-4H,1-2H3
InChIKey
LFVLUOAHQIVABZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Iodofenphos
CAS: 18181-70-9
CID: 28935
Formula: C8H8Cl2IO3PS
MW: 413.00
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight413.00
XLogP35.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass411.83536
Monoisotopic Mass411.83536
Topological Polar Surface Area59.8 Ų
Heavy Atom Count16
Formal Charge0
Complexity276
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