2-Methylvaleric acid 2-methylpentyl ester

CAS	90397-38-9
Structure
Synonyms	Pentanoic acid, 2-methyl-, 2-methylpentyl ester
IUPAC Name	2-Methylpentyl 2-methylpentanoate
Molecular Weight	200.32
Canonical SMILES	CCCC(C)COC(=O)C(C)CCC
InChI	InChI=1S/C12H24O2/c1-5-7-10(3)9-14-12(13)11(4)8-6-2/h10-11H,5-9H2,1-4H3
InChI Key	UMFWRNLJDQMTFR-UHFFFAOYSA-N
Boiling Point	101-103 °C
Purity	98%+
Density	0.867±0.06 g/cm³
Exact Mass	200.177630004
Monoisotopic Mass	200.177630004
Topological Polar Surface Area	26.3 Ų