ChemicalBook--->CAS DataBase List--->55332-38-2

55332-38-2

55332-38-2 Structure

55332-38-2 Structure
IdentificationBack Directory
[Name]

ESFENVALERATE FREE ACID METABOLITE
[CAS]

55332-38-2
[Synonyms]

S-2-(4-chlorophenyl)-3-methylbutyricacid
(S)-2-(4-Chlorophenyl)-3-methylbutanoicaci
Benzeneacetic acid, 4-chloro-α-(1-methylethyl)-, (αS)-
Benzeneacetic acid, 4-chloro-a-(1-methylethyl)-, (aS)-
Esfenvalerate free acid metabolite, 10 μg /μL in cyclohexane
Benzeneacetic acid, 4-chloro-alpha-(1-methylethyl)-, (alphaS)-
[Molecular Formula]

C11H13ClO2
[MDL Number]

MFCD04112625
[MOL File]

55332-38-2.mol
[Molecular Weight]

212.68
Chemical PropertiesBack Directory
[Melting point ]

89-91 °C
[Boiling point ]

318.7±17.0 °C(Predicted)
[density ]

1.184±0.06 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,Room Temperature
[solubility ]

Chloroform (Slightly), Methanol (Slightly)
[form ]

Solid
[pka]

4.13±0.10(Predicted)
[color ]

White to Off-White
[Optical Rotation]

Consistent with structure
[CAS DataBase Reference]

55332-38-2
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Diethylamine-->DL-ALPHA-METHYLBENZYLAMINE-->4-Chlorophenylacetic acid-->2-Chloropropane-->Potassium hydroxide-->1,3-Cyclohexadiene, 5,5-dimethyl--->Water
[Preparation Products]

Esfenvalerate
Safety DataBack Directory
[HS Code ]

2916399090
Hazard InformationBack Directory
[Chemical Properties]

S-2-(4-chlorophenyl)-3-methylbutanoic acid is a white solid, mp106~107℃, insoluble in water, soluble in organic solvents such as toluene and benzene.
[Uses]

S-2-(4-chlorophenyl)-3-methylbutyric acid is an intermediate of S-fenvalerate (also known as S,S-fenvalerate, esfenvalerate), which can be used in related chemical in experimental research.
[Synthesis]

S-2-(4-chlorophenyl)-3-methylbutyric acid can be used with racemic 2-(4-chlorophenyl)-3-methylbutyric acid (referred to as butyric acid) with α-methylbenzylamine It can be obtained by splitting, but it is generally prepared by the dominant crystallization separation method in industry,.
[References]

[1] Patent: US4307034, 1981, A
Spectrum DetailBack Directory
[Spectrum Detail]

ESFENVALERATE FREE ACID METABOLITE(55332-38-2)1HNMR
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