Acetophenone

Catalog	ACM98862
CAS	98-86-2
Structure
Description	Acetophenone is the organic compound with the formula C6H5C(O)CH3 (also represented by the letters PhAc or BzMe), is the simplest aromatic ketone. This colourless, viscous liquid is a precursor to useful resins and fragrances.
Synonyms	Acetyl-benzen
IUPAC Name	1-Phenylethanone
Molecular Weight	120.15
Molecular Formula	C8H8O
Canonical SMILES	CC(=O)C1=CC=CC=C1
InChI	InChI=1S/C8H8O/c1-7(9)8-5-3-2-4-6-8/h2-6H,1H3
InChI Key	KWOLFJPFCHCOCG-UHFFFAOYSA-N
Boiling Point	202 °C(lit.)
Melting Point	19-20 °C(lit.)
Flash Point	180 °F
Purity	99%+
Density	1.03 g/mL at 25 °C(lit.)
Solubility	Slightly soluble in water
Appearance	Clear colorless to light yellow liquid
Storage	Store below +30 °C
Exact Mass	120.057514874
Monoisotopic Mass	120.057514874
Physical State	Liquid
Refractive Index	n20/D 1.534(lit.)
Storage Conditions	Below +30 °C
Topological Polar Surface Area	17.1 Ų