Citronellyl butyrate

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Catalog Number
ACM141162
Product Name
Citronellyl butyrate
Structure
Structure
CAS
141-16-2
Category
Heterocyclic Organic Compound
Synonyms
2,6-Dimethyl-2-octen-8-yl butyrate
IUPAC Name
3,7-Dimethyloct-6-enyl butanoate
Molecular Weight
226.35
Molecular Formula
C14H26O2
Canonical SMILES
CCCC(=O)OCCC(C)CCC=C(C)C
InChI
InChI=1S/C14H26O2/c1-5-7-14(15)16-11-10-13(4)9-6-8-12(2)3/h8,13H,5-7,9-11H2,1-4H3
InChI Key
XQPZQXTWYZAXAK-UHFFFAOYSA-N
Boiling Point
245 °C
Melting Point
-22.4 °C
Flash Point
>230 °F
Density
0.873 g/mL at 25 °C(lit.)
Solubility
Miscible with alcohol, ether, most fixed oils, chloroform; insoluble in water
Assay
0.99
Exact Mass
226.193280068
MDL Number
MFCD00036581
Monoisotopic Mass
226.193280068
Packaging
100 g
Physical State
Liquid
Refractive Index
n20/D 1.445(lit.)
Topological Polar Surface Area
26.3 Ų
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