Structure

3-Octyl acetate

CAS
4864-61-3
Catalog Number
ACM4864613
Category
Other Products
Molecular Weight
172.26
Molecular Formula
C10H20O2

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Specification

Synonyms
3-Octyl acetate, 3-Octanol, acetate, 3-Octanol acetate, Oct-3-yl ethanoate, 1-Ethyl hexyl acetate, Amyl ethyl carbinyl acetate, 3-Octyl acetate (natural), FEMA No. 3583, EINECS 225-471-1, 4864-61-3, octan-3-yl acetate, AC1LAVBO, 3-Octanol, 3-acetate, 3-OCTANYL ACETATE, AGN-PC-00C9WC, UNII-8M41FR2J6W, W358304_ALDRICH, [(3R)-octan-3-yl] acetate, CTK6D6924, AG-A-62141
IUPAC Name
octan-3-yl acetate
Canonical SMILES
CCCCCC(CC)OC(=O)C
InChI Key
STZUZYMKSMSTOU-UHFFFAOYSA-N
Boiling Point
99ºC18 mm Hg(lit.)
Flash Point
157 °F
Density
0.86 g/mL at 25°C(lit.)
Solubility
water, 38.59 mg/L @ 25 °C (est)
Appearance
Colorless clear liquid (est)
Assay
0.97
EC Number
225-471-1
Exact Mass
172.14600
Hazard Statements
Xi
H-Bond Acceptor
2
H-Bond Donor
0
MDL Number
MFCD00015349
Packaging
1 kg
Refractive Index
n20/D 1.415(lit.)
Safety Description
26-36/37
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