14-Heptacosanone

Catalog	ACM542507
CAS	542-50-7
Structure
Synonyms	Myristic ketone
IUPAC Name	Heptacosan-14-one
Molecular Weight	394.7
Molecular Formula	C27H54O
Canonical SMILES	CCCCCCCCCCCCCC(=O)CCCCCCCCCCCCC
InChI	InChI=1S/C27H54O/c1-3-5-7-9-11-13-15-17-19-21-23-25-27(28)26-24-22-20-18-16-14-12-10-8-6-4-2/h3-26H2,1-2H3
InChI Key	VCZMOZVQLARCOE-UHFFFAOYSA-N
Boiling Point	443.86 °C
Melting Point	76-78 °C
Flash Point	56.1ºC
Purity	95%+
Density	0.8686 g/mL at 20 °C(lit.)
Exact Mass	394.417466342
Monoisotopic Mass	394.417466342
Physical State	Solid
Refractive Index	n20/D 1.4758(lit.)
Storage Conditions	Room Temperature
Topological Polar Surface Area	17.1 Ų