ISOBUTYL TIGLATE

Catalog	ACM61692840
CAS	61692-84-0
Structure
Synonyms	Tiglic acid isobutyl ester
IUPAC Name	2-Methylpropyl (E)-2-methylbut-2-enoate
Molecular Weight	156.22
Molecular Formula	C9H16O2
Canonical SMILES	CC=C(C)C(=O)OCC(C)C
InChI	InChI=1S/C9H16O2/c1-5-8(4)9(10)11-6-7(2)3/h5,7H,6H2,1-4H3/b8-5+
InChI Key	XDEGQMQKHFPBEW-VMPITWQZSA-N
Boiling Point	182-184 °C
Flash Point	153 °F
Purity	95%+
Density	0.899 g/mL at 25 °C(lit.)
Exact Mass	156.115029749
Isomeric SMILES	C/C=C(\C)/C(=O)OCC(C)C
Monoisotopic Mass	156.115029749
Refractive Index	n20/D 1.438(lit.)
Topological Polar Surface Area	26.3 Ų