Ibuprofen

Molecular Formula:

C₁₃H₁₈O₂

Molecular Weight:

206.285 g/mol

Cas Number:

15687-27-1

InChIKey:

HEFNNWSXXWATRW-YHMJCDSICY

Smiles:

CC(C)CC1=CC=C(C=C1)C(C)C(O)=O

Synthesis Reference

Chemical and Pharmaceutical Bulletin, 31, p. 3139, 1983
The Journal of Organic Chemistry, 52, p. 287, 1987
Synthesis, p. 645, 1986

Synonym Name(s)

2-(4-isobutylphenyl)propanoic acid
2-(4-isobutylphenyl)propionic acid
2-[4-(2-methylpropyl)phenyl]propanoic acid

Properties

Melting Point: 75-78 ºC

Boiling Point: 157 ºC (4 mmHg)

Density: n/a

H1 NMR Spectrum:

Associated Data Sources

ChemSpider ID: 3544
PubChem Compound ID: 3672

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