4-(4-Hydroxyphenyl)-2-Butanone

Catalog	ACM5471512-1
CAS	5471-51-2
Structure
Synonyms	Raspberry ketone
IUPAC Name	4-(4-Hydroxyphenyl)butan-2-one
Molecular Weight	164.2
Molecular Formula	C10H12O2
Canonical SMILES	CC(=O)CCC1=CC=C(C=C1)O
InChI	InChI=1S/C10H12O2/c1-8(11)2-3-9-4-6-10(12)7-5-9/h4-7,12H,2-3H2,1H3
InChI Key	NJGBTKGETPDVIK-UHFFFAOYSA-N
Boiling Point	200 °C
Melting Point	81-85 °C
Purity	98%
Density	1.0326 g/mL at 25 °C(lit.)
Solubility	Insoluble in water
Appearance	Powder
Exact Mass	164.083729621
Monoisotopic Mass	164.083729621
Physical State	Liquid
Refractive Index	n20/D 1.5250(lit.)
Storage Conditions	Inert atmosphere
Topological Polar Surface Area	37.3 Ų