Monoisobutyl phthalate

CAS Registry Number®

30833-53-5

CAS Name

Monoisobutyl phthalate

Molecular Formula

C12H14O4

Molecular Mass

222.24

Cite this Page

Monoisobutyl phthalate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=30833-53-5 (retrieved 2024-11-22) (CAS RN: 30833-53-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    50 °C

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C12H14O4/c1-8(2)7-16-12(15)10-6-4-3-5-9(10)11(13)14/h3-6,8H,7H2,1-2H3,(H,13,14)

InChIKey

InChIKey=RZJSUWQGFCHNFS-UHFFFAOYSA-N

SMILES

C(OCC(C)C)(=O)C1=C(C(O)=O)C=CC=C1

Canonical SMILES

O=C(O)C=1C=CC=CC1C(=O)OCC(C)C

Other Names for this Substance

  • 1,2-Benzenedicarboxylic acid, 1-(2-methylpropyl) ester
  • 1,2-Benzenedicarboxylic acid, mono(2-methylpropyl) ester
  • Phthalic acid, monoisobutyl ester
  • Monoisobutyl phthalate
  • Mono(2-isobutyl) phthalate

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration