Methyl Tiglate

Catalog	ACM6622760
CAS	6622-76-0
Structure
Synonyms	Tiglic acid methyl ester
IUPAC Name	Methyl (E)-2-methylbut-2-enoate
Molecular Weight	114.14
Molecular Formula	C6H10O2
Canonical SMILES	CC=C(C)C(=O)OC
InChI	InChI=1S/C6H10O2/c1-4-5(2)6(7)8-3/h4H,1-3H3/b5-4+
InChI Key	YYJWBYNQJLBIGS-SNAWJCMRSA-N
Boiling Point	137-138 °C
Melting Point	37.22 °C
Flash Point	95 °F
Purity	95%+
Density	0.95 g/mL at 25 °C(lit.)
Appearance	Colorless liquid
Exact Mass	114.068079557
Isomeric SMILES	C/C=C(\C)/C(=O)OC
Monoisotopic Mass	114.068079557
Refractive Index	n20/D 1.436(lit.)
Storage Conditions	Flammables area
Topological Polar Surface Area	26.3 Ų