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10-Methylundecanoic acid

10-Methylundecanoic acid structure

CAS No:
2724-56-3
Formula:
C12H24O2
Chemical Name:
10-Methylundecanoic acid
Synonyms:
Undecanoic acid,10-methyl-;10-Methylundecanoic acid;Isolauric acid;Isododecanoic acid
Categories:
Analytical Chemistry > Food Safety

Description

ChEBI: A methyl-branched fatty acid that is undecanoic acid substituted by a methyl group at position 10.

10-methylundecanoic acid is a methyl-branched fatty acid that is undecanoic acid substituted by a methyl group at position 10. It is a branched-chain saturated fatty acid, a methyl-branched fatty acid and a medium-chain fatty acid. It derives from an undecanoic acid.

10-Methylundecanoic acid Basic Attributes

Molecular Weight：

200.32

Exact Mass：

200.32

DSSTox ID：

DTXSID70181693

HScode：

2915900090

Characteristics

PSA：

37.30000

XLogP3：

3.84780

Appearance：

Liquid

Density：

0.903 g/cm3

Melting Point：

38-39 °C

Boiling Point：

140-145 °C @ Press: 3 Torr

Flash Point：

165.7ºC

Refractive Index：

1.446

Storage Conditions：

−20°C

Safety Information

wgk germany：

hazard class code：

36/37/38

safety instructions：

26-36

Marks：

Precautionary statement(s)：

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501

Hazard Statements：

H315

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

10-Methylundecanoic acid Use and Manufacturing

Use Classification：

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

Computed Properties

Molecular Weight:200.32
XLogP3:4.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:9
Exact Mass:200.177630004
Monoisotopic Mass:200.177630004
Topological Polar Surface Area:37.3
Heavy Atom Count:14
Complexity:141
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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10-METHYLUNDECANOIC ACID

CAS No.: 2724-56-3

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