(+)-Ibuprofen

CAS Registry Number®

51146-56-6

CAS Name

(+)-Ibuprofen

Molecular Formula

C13H18O2

Molecular Mass

206.28

Cite this Page

(+)-Ibuprofen.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=51146-56-6 (retrieved 2024-11-22) (CAS RN: 51146-56-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    110 °C @ Press: 0.1 Torr

  • Melting Point (2)

    54 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C13H18O2/c1-9(2)8-11-4-6-12(7-5-11)10(3)13(14)15/h4-7,9-10H,8H2,1-3H3,(H,14,15)/t10-/m0/s1

InChIKey

InChIKey=HEFNNWSXXWATRW-JTQLQIEISA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Benzeneacetic acid, α-methyl-4-(2-methylpropyl)-, (αS)-
  • Benzeneacetic acid, α-methyl-4-(2-methylpropyl)-, (S)-
  • (αS)-α-Methyl-4-(2-methylpropyl)benzeneacetic acid
  • (+)-Ibuprofen
  • d-Ibuprofen

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration