Linalyl acetate

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Catalog Number
ACM115957
Product Name
Linalyl acetate
Structure
Structure
CAS
115-95-7
Category
Heterocyclic Organic Compound
Synonyms
Linalolacetate
IUPAC Name
3,7-Dimethylocta-1,6-dien-3-yl acetate
Molecular Weight
196.29
Molecular Formula
C12H20O2
Canonical SMILES
CC(=CCCC(C)(C=C)OC(=O)C)C
InChI
InChI=1S/C12H20O2/c1-6-12(5,14-11(4)13)9-7-8-10(2)3/h6,8H,1,7,9H2,2-5H3
InChI Key
UWKAYLJWKGQEPM-UHFFFAOYSA-N
Boiling Point
220 °C(lit.)
Melting Point
85 °C
Flash Point
194 °F
Density
0.901 g/mL at 25 °C(lit.)
Solubility
Insoluble in water
Appearance
Clear colorless liquid
Storage
-20 °C
Assay
0.98
Complexity
237
EC Number
204-116-4
Exact Mass
196.146329876
Hazard Statements
Xi:Irritant;
H-Bond Acceptor
2
H-Bond Donor
0
MDL Number
MFCD00008907
Monoisotopic Mass
196.146329876
Packaging
1 kg
Physical State
Liquid
Refractive Index
n20/D 1.453(lit.)
Safety Description
S37
Stability
Stable under normal temperatures and pressures.
Storage Conditions
-20 °C
Topological Polar Surface Area
26.3 Ų
WGK Germany
1
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