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Structure

Geranyl propionate

CAS
105-90-8
Catalog Number
ACM105908
Category
Other Products
Molecular Weight
210.31
Molecular Formula
C13H22O2

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Specification

Synonyms
2,6-Octadien-1-ol, 3,7-dimethyl-, propanoate
IUPAC Name
[(2E)-3,7-Dimethylocta-2,6-dienyl] propanoate
Canonical SMILES
CCC(=O)OCC=C(C)CCC=C(C)C
InChI
InChI=1S/C13H22O2/c1-5-13(14)15-10-9-12(4)8-6-7-11(2)3/h7,9H,5-6,8,10H2,1-4H3/b12-9+
InChI Key
BYCHQEILESTMQU-FMIVXFBMSA-N
Boiling Point
252 °C
Flash Point
>230 °F
Density
0.899 g/mL at 25 °C(lit.)
Solubility
Soluble in alcohol, most fixed oils; insoluble in glycerol, propylene glycol
Assay
0.97
Exact Mass
210.16197994
Isomeric SMILES
CCC(=O)OC/C=C(\C)/CCC=C(C)C
Monoisotopic Mass
210.16197994
Packaging
100 g
Physical State
Liquid
Refractive Index
n20/D 1.456(lit.)
Topological Polar Surface Area
26.3 Ų
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