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4-Methyl Octanoic Acid

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4-Methyl Octanoic Acid / CAS : 54947-74-9

Appearance liquid UN 3265
HS 29159000 DG Class 8
Synonyms Octanoic Acid, 4-Methyl-; 4-Methylcaprylic Acid; 4-Methyl-N-Octanoic Acid; Octanoic Acid,4-Methyl; (R,S)-(+/-)-4-Methyloctanoic Acid
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Properties

Summary

Formula
C9H18O2
Molecular Mass
158.23800
Exact Mass
158.13100
PSA
37.30000
Logp
2.67750
IUPAC
4-methyloctanoic acid
SMILES
CCCCC(C)CCC(=O)O

Attribute classification

Matter Classification
organic
Category
API & Intermediate > Pharmaceutical Intermediates
Food(Feed) Additives > Food Additive
Flavors and Fragrances > Spice

Chemical and Physical Properties

Melting Point
-29.5°C
Density
0.91 g/mL 
Boiling Point
149 °C
Flash Point
>230 °F
Appearance
liquid

Export information

HS Code
29159000
Export Rebate
13%
UN No.
3265
DG-Class
8
Risk Code
R34-36/37/38-21/22
Safety Label
C,Xi,Xn

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