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Hexadecanedioic acid

Hexadecanedioic acid structure

CAS No:
505-54-4
Formula:
C16H30O4
Chemical Name:
Hexadecanedioic acid
Synonyms:
Hexadecanedioic acid;1,14-Tetradecanedicarboxylic acid;Thapsic acid;n-Tetradecane-ω,ω′-dicarboxylic acid;1,16-Hexadecanedioic acid;α,ω-Tetradecanedicarboxylic acid;NSC 15164
Categories:
Chemical Reagents > Organic Reagents

Description

Hexadecanedioic acid is covalently linked to Sepharose 4B, shows better performance in terms of specificity than dye-based resins and could be used for depletion of SA from plasma samples.

Solid

Hexadecanedioic acid is an alpha,omega-dicarboxylic acid that is the 1,14-dicarboxy derivative of tetradecane. It has a role as a human metabolite. It is an alpha,omega-dicarboxylic acid and a lipid. It is a conjugate acid of a hexadecanedioate(2-).

Hexadecanedioic acid Basic Attributes

Molecular Weight：

286.41

Exact Mass：

286.41

EC Number：

208-013-5

UNII：

SVZ90045Y2

NSC Number：

15164

DSSTox ID：

DTXSID2060129

HScode：

2917190090

Characteristics

PSA：

74.6

XLogP3：

5.4

Appearance：

Solid

Density：

1.0±0.1 g/cm3

Melting Point：

113 °C

Boiling Point：

184-188 °C @ Press: 0.07 Torr

Flash Point：

244.6±17.7 °C

Refractive Index：

1.475

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

R36/37/38

safety instructions：

S24/25

Stability/Shelf Life：

Stable. Incompatible with bases, oxidizing agents, reducing agents. Combustible.

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

Drug Information

MeSH Entry Terms：

hexadecanedioic acid

Hexadecanedioic acid Use and Manufacturing

Manufacturing Info：

Hexadecanedioic acid: ACTIVE

Use Classification：

Fatty Acyls [FA] -> Fatty Acids and Conjugates [FA01] -> Dicarboxylic acids [FA0117]

Computed Properties

Molecular Weight:286.41
XLogP3:5.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:15
Exact Mass:286.21440943
Monoisotopic Mass:286.21440943
Topological Polar Surface Area:74.6
Heavy Atom Count:20
Complexity:225
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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