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Substance Name: Esfenvalerate [ISO]
RN: 66230-04-4
UNII: 7F07OXM0PP
InChIKey: NYPJDWWKZLNGGM-RPWUZVMVSA-N

Molecular Formula

  • C25-H22-Cl-N-O3

Molecular Weight

  • 419.9058
 

Classification Codes

Classification Codes

  • Agricultural Chemical
  • Growth Regulator
  • Insecticide
  • Tumor Data

Superlist Classification Code

  • Overall Carcinogenic Evaluation: Group 3
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Names and Synonyms

Results Name

  • Esfenvalerate [ISO]

Name of Substance

  • Esfenvalerate

Synonyms

  • (S)-alpha-Cyano-3-phenoxybenzyl (S)-2-(4-chlorophenyl)-3-methylbutyrate
  • (S)-alpha-Cyano-3-phenoxybenzyl(S)-2-(4-chlorophenyl)-3-methylbutyrate
  • (S-(R*,R*))-Cyano(3-phenoxyphenyl)methyl 4-chloro-2-(1-methylethyl)benzeneacetate
  • A alpha
  • Asana
  • Asana XL
  • BRN 4275674
  • Esfenvalerate
  • Fenvalerate (S,S)-isomer
  • Fenvalerate A alpha
  • Fenvalerate alpha
  • Halmark
  • HSDB 6625
  • OMS 3023
  • S 1844
  • S 5602 A alpha
  • S-1844
  • S-5620A alpha
  • Sumi-alfa
  • Sumi-alpha
  • Sumiciclin Aalpha
  • Sumicidin A alpha
  • UNII-7F07OXM0PP

Systematic Names

  • Benzeneacetic acid, 4-chloro-alpha-(1-methylethyl)-, (S)-cyano(3-phenoxyphenyl)methyl ester, (alphaS)-
  • Benzeneacetic acid, 4-chloro-alpha-(1-methylethyl)-, cyano(3-phenoxyphenyl)methyl ester, (S-(R*,R*))-

Superlist Name

  • Esfenvalerate

Registry Numbers

CAS Registry Number

  • 66230-04-4

FDA UNII

  • 7F07OXM0PP

Other Registry Number

  • 72650-28-3

System Generated Number

  • 0066230044

Structure Descriptors

InChI

1S/C25H22ClNO3/c1-17(2)24(18-11-13-20(26)14-12-18)25(28)30-23(16-27)19-7-6-10-22(15-19)29-21-8-4-3-5-9-21/h3-15,17,23-24H,1-2H3/t23-,24+/m1/s1

InChIKey

NYPJDWWKZLNGGM-RPWUZVMVSA-N

Smiles

CC(C)[C@H](C(=O)O[C@H](C#N)c1cccc(Oc2ccccc2)c1)c3ccc(Cl)cc3

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 skin > 2gm/kg (2000mg/kg)   Farm Chemicals Handbook. Vol. -, Pg. C27, 1991.
rat LD50 oral 325mg/kg (325mg/kg)   Farm Chemicals Handbook. Vol. -, Pg. C287, 1991.
rat LD50 skin > 5gm/kg (5000mg/kg)   Farm Chemicals Handbook. Vol. -, Pg. C287, 1991.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 59.5 deg C   EXP
log P (octanol-water) 6.22 (none)   EXP
Water Solubility 0.002 mg/L 25 EXP
Vapor Pressure 1.50E-09 mm Hg 25 EXP
Henry's Law Constant 4.14E-07 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 3.76E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.