2-(4-Chlorophenyl)-3-methylbutyric acid

CAS Registry Number®

2012-74-0
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CAS Name

2-(4-Chlorophenyl)-3-methylbutyric acid

Molecular Formula

C11H13ClO2

Molecular Mass

212.67

Cite this Page

2-(4-Chlorophenyl)-3-methylbutyric acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=2012-74-0 (retrieved 2024-04-27) (CAS RN: 2012-74-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    89-90 °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)

InChIKey

InChIKey=VTJMSIIXXKNIDJ-UHFFFAOYSA-N

SMILES

C(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)-
  • Butyric acid, 2-(p-chlorophenyl)-3-methyl-
  • 4-Chloro-α-(1-methylethyl)benzeneacetic acid
  • 4-Chloro-α-isopropylphenylacetic acid
  • 2-(p-Chlorophenyl)-3-methylbutyric acid

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Deleted or Replaced CAS Registry Numbers

55291-27-5, 2696440-96-5

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