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3-Methylbutyl Octanoate

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3-Methylbutyl Octanoate / CAS : 2035-99-6

Appearance Colorless liquid with fruit aroma. UN 0.0
HS 29159000 DG Class 0.0
Synonyms Isopentyl Octylate; Octanoic Acid,3-Methylbutyl Ester; Isopentyl Octanoate; Octanoic Acid,Isopentyl Ester; Isoamyl N-Octanoate; Isoamyl Caprylate; Octanoicacid,Isopentylester
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Properties

Summary

Formula
C13H26O2
Molecular Mass
214.34400
Exact Mass
214.19300
PSA
26.30000
Logp
3.93620
IUPAC
3-methylbutyl octanoate
SMILES
CCCCCCCC(=O)OCCC(C)C

Attribute classification

Matter Classification
organic
Category
Food(Feed) Additives > Food Additive
Flavors and Fragrances > Spice

Chemical and Physical Properties

Melting Point
-34.8°C
Density
0.861 g/mL
Boiling Point
267-268 °C
Flash Point
>230 °F
Appearance
Colorless liquid with fruit aroma.
Acidity and Basicity
neutral

Export information

HS Code
29159000
Export Rebate
13%
UN No.
0.0
DG-Class
0.0
Risk Code
R36/37/38
Safety Label
Xi

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