Paeonol

Catalog	ACM552410
CAS	552-41-0
Structure
Synonyms	2'-Hydroxy-4'-methoxyacetophenone
IUPAC Name	1-(2-Hydroxy-4-methoxyphenyl)ethanone
Molecular Weight	166.18
Molecular Formula	C9H10O3
Canonical SMILES	CC(=O)C1=C(C=C(C=C1)OC)O
InChI	InChI=1S/C9H10O3/c1-6(10)8-4-3-7(12-2)5-9(8)11/h3-5,11H,1-2H3
InChI Key	UILPJVPSNHJFIK-UHFFFAOYSA-N
Boiling Point	154 °C /20mmHg
Melting Point	48-50 °C (lit.)
Flash Point	>230 °F
Purity	98%
Density	1.31 g/ml
Solubility	water, 4965 mg/L @ 25 °C (est)
Appearance	White to light-yellow powder
Exact Mass	166.062994177
Monoisotopic Mass	166.062994177
Physical State	Crystalline solid
Refractive Index	n20/D 1.5452(lit.)
Storage Conditions	2-8 °C
Topological Polar Surface Area	46.5 Ų