Citronellyl tiglate

Catalog	ACM24717859
CAS	24717-85-9
Structure
Synonyms	Citronellyl trans-2-methyl-2-butenoate
IUPAC Name	3,7-Dimethyloct-6-enyl (E)-2-methylbut-2-enoate
Molecular Weight	238.37
Molecular Formula	C15H26O2
Canonical SMILES	CC=C(C)C(=O)OCCC(C)CCC=C(C)C
InChI	InChI=1S/C15H26O2/c1-6-14(5)15(16)17-11-10-13(4)9-7-8-12(2)3/h6,8,13H,7,9-11H2,1-5H3/b14-6+
InChI Key	UCFQYMKLDPWFHZ-MKMNVTDBSA-N
Boiling Point	144-145 °C
Flash Point	>230 °F
Purity	95%+
Density	0.903 g/mL at 25 °C(lit.)
Solubility	Practically insoluble to insoluble in water
Appearance	Colorless clear liquid (est)
Exact Mass	238.193280068
Isomeric SMILES	C/C=C(\C)/C(=O)OCCC(C)CCC=C(C)C
Monoisotopic Mass	238.193280068
Odor	Winey rosy aroma
Physical State	Liquid
Refractive Index	n20/D 1.465(lit.)
Topological Polar Surface Area	26.3 Ų