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8-METHYLNONANOIC ACID

8-METHYLNONANOIC ACID structure

CAS No:
5963-14-4
Formula:
C10H20O2
Chemical Name:
8-METHYLNONANOIC ACID
Synonyms:
ISODECANOIC ACID;8-METHYLNONANOIC ACID;8-METHYLNONANOIC ACID 97%;8-Methylnonanoic acid,97%;8-Methylpelargonic acid;Isocapric Acid
Categories:
Analytical Chemistry > Food Safety

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Description

clear colorless to yellow liquid

8-methyl Nonanoic acid is a medium-chain fatty acid.

8-METHYLNONANOIC ACID Basic Attributes

Molecular Weight：

172.26

Exact Mass：

172.146332

EC Number：

247-673-9

UNII：

LW5786QCKT|YL95S7AP4Z

DSSTox ID：

DTXSID1067207

HScode：

2915900090

Characteristics

PSA：

37.3

XLogP3：

3.78

Appearance：

Clear colorless to yellow Liquid

Density：

0.9±0.1 g/cm3

Melting Point：

15-19 °C

Boiling Point：

118-120 °C (2 mmHg)

Flash Point：

142.3±6.9 °C

Refractive Index：

1.442

Storage Conditions：

−20°C

Safety Information

hazard class code：

36/37/38

safety instructions：

37/39-26

Marks：

8-METHYLNONANOIC ACID Use and Manufacturing

Uses

Intermediate for metal salts, ester type lubricants, plasticizers.

Manufacturing Info：

Isodecanoic acid: ACTIVE

Use Classification：

Fatty Acyls [FA] -> Fatty Acids and Conjugates [FA01] -> Branched fatty acids [FA0102]

Computed Properties

Molecular Weight:172.26
XLogP3:3.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:7
Exact Mass:172.146329876
Monoisotopic Mass:172.146329876
Topological Polar Surface Area:37.3
Heavy Atom Count:12
Complexity:119
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes