CITRONELLYL ISOBUTYRATE

Datasheet MSDS
Catalog Number
AFG2035
Product Name
CITRONELLYL ISOBUTYRATE
Structure
CITRONELLYL ISOBUTYRATE
CAS Number
97-89-2
IUPAC Name
3,7-dimethyloct-6-enyl 2-methylpropanoate
Synonyms
CITRONELLYLISOBUTYRATE; CITRONELLYL2-METHYLPROPIONATE; FEMA2313; 2-methylpropanoicacid3,7-dimethyl-oct-6-en-1-ylester; 3,7-Dimethyl-6-octenyl2-methylpropanoate; Isobutyricacid,3,7-dimethyl-6-octenylester; Propanoicacid,2-methyl-,3,7-dimethyl-6-octenylester; Propanoicacid,2-methyl-,3,7-dimethyl-6-octenylester
Molecular Formula
C14H26O2
Molecular Weight
226.36
Appearance
colorless liquid
Purity
94%
Density
0.875 g/mL at 25°C (lit.)
Solubility
Insoluble in water; soluble in alcohol.
Melting Point
-22.4°C (estimate)
Boiling Point
253°C (lit.)
Storage
Store tightly sealed under inert gas in a cool, well-ventilated area.
Description
Spices. Mainly used for the preparation of raspberry, grape and other fruit flavor.
SMILES
CC(C)C(=O)OCCC(C)CCC=C(C)C
InChI
InChI=1S/C14H26O2/c1-11(2)7-6-8-13(5)9-10-16-14(15)12(3)4/h7,12-13H,6,8-10H2,1-5H3
InChI Key
ZGPPERKMXSGYRK-UHFFFAOYSA-N
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