Methyl octine carbonate

CAS	111-80-8
Structure
Synonyms	Methyl non-2-ynoate
IUPAC Name	2-Nonynoic acid methyl ester
Molecular Weight	168.23
Canonical SMILES	CCCCCCC#CC(=O)OC
InChI	InChI=1S/C10H16O2/c1-3-4-5-6-7-8-9-10(11)12-2/h3-7H2,1-2H3
InChI Key	NTLJTUMJJWVCTL-UHFFFAOYSA-N
Boiling Point	121 °C
Flash Point	213 °F
Purity	98%+
Density	0.915 g/mL at 25 °C(lit.)
Solubility	Soluble in oils; insoluble in water
Exact Mass	168.115029749
Monoisotopic Mass	168.115029749
Odor	Peach, violet aroma
Physical State	Oily liquid
Refractive Index	n20/D 1.448(lit.)
Storage Conditions	2-8 °C
Topological Polar Surface Area	26.3 Ų