1-(2,4-Dihydroxy-3,5-Dimethylphenyl)-Ethanone
[CAS# 577-45-7]

Identification

• Name: 1-(2,4-Dihydroxy-3,5-Dimethylphenyl)-Ethanone
• Synonyms: 1-(2,4-Dihydroxy-3,5-Dimethyl-Phenyl)Ethanone; Ethanone, 1-(2,4-Dihydroxy-3,5-Dimethylphenyl)-; Acetylphenone, 2',4'-Dihydroxy-3',5'-Dimethyl-
• Molecular Formula: C₁₀H₁₂O₃
• Molecular Weight: 180.20
• CAS Registry Number: 577-45-7
• SMILES: C1=C(C(=C(C)C(=C1C)O)O)C(=O)C
• InChI: 1S/C10H12O3/c1-5-4-8(7(3)11)10(13)6(2)9(5)12/h4,12-13H,1-3H3
• InChIKey: AMZNYVFIWCPUAY-UHFFFAOYSA-N

Properties

• Density: 1.198g/cm³ (Cal.)
• Boiling point: 350.204°C at 760 mmHg (Cal.)
• Flash point: 179.792°C (Cal.)

References

• (1): S.-Y. Li, J.-F. Wang, Z.-H. Zheng, Q.-Y. Xu, Y.-J. Huang, Y.-F. Zhao and W.-J. Su. 1-(2,4-Dihydroxy-3,5-dimethylphenyl)-ethanone (Clavatol), Acta Cryst. (2003). E59, o1469-o1470