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Structure

1-Octen-3-yl acetate

CAS
2442-10-6
Catalog Number
ACM2442106
Category
Other Products
Molecular Weight
170.25
Molecular Formula
C10H18O2

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Specification

Synonyms
1-Pentylallylacetate
IUPAC Name
Oct-1-en-3-yl acetate
Canonical SMILES
CCCCCC(C=C)OC(=O)C
InChI
InChI=1S/C10H18O2/c1-4-6-7-8-10(5-2)12-9(3)11/h5,10H,2,4,6-8H2,1,3H3
InChI Key
DOJDQRFOTHOBEK-UHFFFAOYSA-N
Boiling Point
80 °C
Melting Point
-89.9 °C
Flash Point
165 °F
Density
0.878 g/mL at 25 °C(lit.)
Solubility
water, 51.58 mg/L @ 25 °C (est)
Appearance
Colorless clear liquid (est)
Assay
0.99
EC Number
219-474-7
Exact Mass
170.130679813
MDL Number
MFCD00036568
Monoisotopic Mass
170.130679813
Packaging
25 kg/DRUMS
Physical State
Liquid
Refractive Index
n20/D 1.425(lit.)
Storage Conditions
2-8 °C
Topological Polar Surface Area
26.3 Ų
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