(αS)-4-Chloro-α-(1-methylethyl)benzeneacetic acid

CAS Registry Number®

55332-38-2

CAS Name

(αS)-4-Chloro-α-(1-methylethyl)benzeneacetic acid

Molecular Formula

C11H13ClO2

Molecular Mass

212.67

Cite this Page

(αS)-4-Chloro-α-(1-methylethyl)benzeneacetic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=55332-38-2 (retrieved 2024-11-21) (CAS RN: 55332-38-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    89-91 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C11H13ClO2/c1-7(2)10(11(13)14)8-3-5-9(12)6-4-8/h3-7,10H,1-2H3,(H,13,14)/t10-/m0/s1

InChIKey

InChIKey=VTJMSIIXXKNIDJ-JTQLQIEISA-N

SMILES

[C@@H](C(C)C)(C(O)=O)C1=CC=C(Cl)C=C1

Canonical SMILES

O=C(O)C(C1=CC=C(Cl)C=C1)C(C)C

Other Names for this Substance

  • Benzeneacetic acid, 4-chloro-α-(1-methylethyl)-, (αS)-
  • Benzeneacetic acid, 4-chloro-α-(1-methylethyl)-, (S)-
  • (αS)-4-Chloro-α-(1-methylethyl)benzeneacetic acid
  • (S)-2-(4-Chlorophenyl)isovaleric acid
  • (+)-α-(p-Chlorophenyl)isovaleric acid

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration