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Phenothrin

CAT: 0931-T1200-01Size: 2 mgDry Ice: NoHazardous: No
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CAT#:0931-T1200-01Size:2 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
26002-80-2
Target
Parasite
Related Pathways
Microbiology/Virology
Purity
0.9804
Bioactivity
Phenothrin (Sumithrin) is a synthetic pyrethroid used to kill adult fleas and ticks.
Smiles
CC(C)=CC1C(C(=O)OCc2cccc(Oc3ccccc3)c2)C1(C)C
Molecular Formula
C23H26O3
Molecular Weight
350.45
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Phenothrin

Phenothrin is a cyclopropanecarboxylate ester. It has a role as a pyrethroid ester insecticide. It is functionally related to a chrysanthemic acid.

CAS Number26002-80-2
PubChem CID4767
IUPAC Name(3-phenoxyphenyl)methyl 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate
Molecular FormulaC23H26O3
Molecular Weight350.4
XLogP6.2
Topological Polar Surface Area35.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count7
Heavy Atom Count26
Formal Charge0
Complexity512
SMILES
CC(=CC1C(C1(C)C)C(=O)OCC2=CC(=CC=C2)OC3=CC=CC=C3)C
InChI
InChI=1S/C23H26O3/c1-16(2)13-20-21(23(20,3)4)22(24)25-15-17-9-8-12-19(14-17)26-18-10-6-5-7-11-18/h5-14,20-21H,15H2,1-4H3
InChIKey
SBNFWQZLDJGRLK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Phenothrin
CAS: 26002-80-2
CID: 4767
Formula: C23H26O3
MW: 350.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight350.4
XLogP36.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count7
Exact Mass350.18819469
Monoisotopic Mass350.18819469
Topological Polar Surface Area35.5 Ų
Heavy Atom Count26
Formal Charge0
Complexity512
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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