CAS Registry Number®
51146-57-7
CAS Name
(-)-Ibuprofen
Molecular Formula
C13H18O2
Molecular Mass
206.28
Compound Properties
-
Melting Point (1)
48-49 °C
Source(s)
- (1) Aureli, Loretta; Journal of Medicinal Chemistry, (2005), 48(7), 2469-2479, CAplus
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-/m1/s1
InChIKey
InChIKey=HEFNNWSXXWATRW-SNVBAGLBSA-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)-, (αR)-
- Benzeneacetic acid, α-methyl-4-(2-methylpropyl)-, (R)-
- (αR)-α-Methyl-4-(2-methylpropyl)benzeneacetic acid
- (-)-Ibuprofen
- R-(-)-p-Isobutylhydratropic acid
- l-Ibuprofen
- (R)-(-)-Ibuprofen
- (R)-Ibuprofen
- (-)-Ibuprophen
- (R)-2-(4-Isobutylphenyl)propanoic acid
- (-)-α-Methyl-4-(2-methylpropyl)benzeneacetic acid
- (R)-2-(4-Isobutylphenyl)propanoic acid
- (2R)-2-[4-(2-Methylpropyl)phenyl]propanoic acid
