γ,γ,4-Trimethylbenzenebutanoic acid

CAS Registry Number®

40663-79-4
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CAS Name

γ,γ,4-Trimethylbenzenebutanoic acid

Molecular Formula

C13H18O2

Molecular Mass

206.28

Cite this Page

γ,γ,4-Trimethylbenzenebutanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=40663-79-4 (retrieved 2024-08-19) (CAS RN: 40663-79-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    140-142 °C @ Press: 1 Torr

  • Density (1)

    1.0375 g/cm³ @ Temp: 25 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C13H18O2/c1-10-4-6-11(7-5-10)13(2,3)9-8-12(14)15/h4-7H,8-9H2,1-3H3,(H,14,15)

InChIKey

InChIKey=VQEPPIPPMVKOMN-UHFFFAOYSA-N

SMILES

C(CCC(O)=O)(C)(C)C1=CC=C(C)C=C1

Canonical SMILES

O=C(O)CCC(C1=CC=C(C=C1)C)(C)C

Other Names for this Substance

  • Benzenebutanoic acid, γ,γ,4-trimethyl-
  • γ,γ,4-Trimethylbenzenebutanoic acid