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Iso-C16:0

Iso-C16:0 structure

CAS No:
4669-02-7
Formula:
C16H32O2
Chemical Name:
Iso-C16:0
Synonyms:
Pentadecanoic acid,14-methyl-;14-Methylpentadecanoic acid;Isopalmitic acid;Isohexadecanoic acid;Iso-C16:0
Categories:
Analytical Chemistry > Food Safety

Description

ChEBI: A methyl-branched fatty acid that is pentadecanoic acid substituted by a methyl group at position 14. It is a biomarker for rheumatoid arthritis.

OtherSolid|Solid

14-methylpentadecanoic acid is a methyl-branched fatty acid that is pentadecanoic acid substituted by a methyl group at position 14. It is a biomarker for rheumatoid arthritis. It has a role as a biomarker and a mammalian metabolite. It is a branched-chain saturated fatty acid, a methyl-branched fatty acid and a long-chain fatty acid. It derives from a pentadecanoic acid.

Iso-C16:0 Basic Attributes

Molecular Weight：

256.42

Exact Mass：

256.42

EC Number：

251-256-7

UNII：

IHU3LRR6SX

DSSTox ID：

DTXSID9067726

Characteristics

PSA：

37.30000

XLogP3：

5.40820

Appearance：

OtherSolid

Density：

0.891g/cm3

Melting Point：

61.5-61.6 °C

Boiling Point：

371ºC at 760mmHg

Flash Point：

207.1ºC

Refractive Index：

1.452

Storage Conditions：

2-8°C

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

36/37/38

safety instructions：

26-36

Marks：

Precautionary statement(s)：

P261-P305 + P351 + P338

Hazard Statements：

H315-H319-H335

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.

Iso-C16:0 Use and Manufacturing

Uses

Lubricants and lubricant additives

Manufacturing Info：

All other basic organic chemical manufacturing|Isohexadecanoic acid: ACTIVE

Use Classification：

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

Computed Properties

Molecular Weight:256.42
XLogP3:6.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:13
Exact Mass:256.240230259
Monoisotopic Mass:256.240230259
Topological Polar Surface Area:37.3
Heavy Atom Count:18
Complexity:188
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Recommended Suppliers of Iso-C16:0

Shaanxi Dideu Medichem Co. Ltd Contact Supplier

CN
5 YRS

Business licensed Certified factory

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14-METHYLPENTADECANOIC ACID

CAS No.: 4669-02-7

Grade: Industrial Grade

Content: 99.0%

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