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Squalene CAS 111-02-4

Trans-squalene is an all-trans triterpene compound with an isoprene structure; due to its six double bonds, it is highly unstable and prone to oxidation. It possesses beneficial functional properties, such as the suppression of oxidative stress and the elimination of inflammatory factors in the body, and is widely used in the food, pharmaceutical and cosmetics industries.
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  • 111-02-4

Squalene Basic information

Product Name:

Squalene

CAS:

111-02-4

MF:

C30H50

MW:

410.72

EINECS:

203-826-1

Mol File:

111-02-4.mol

Squalene Chemical Properties

Melting point

−75 °C(lit.)

Boiling point

285 °C25 mm Hg(lit.)

density

0.858 g/mL at 25 °C(lit.)

vapor pressure

0Pa at 25℃

refractive index

n20/D 1.494(lit.)

Fp

>230 °F

storage temp.

2-8°C

solubility

DMSO : 16.67 mg/mL (40.59 mM; Need ultrasonic)H2O : < 0.1 mg/mL (insoluble)

form

liquid

color

light yellow

Odor

oil, faint odor

biological source

animal

Water Solubility

<0.1 g/100 mL at 19 ºC

Merck

148,768

BRN

1728919

Major Application

environmental

food and beverages

Cosmetics Ingredients Functions

SOLVENT

SKIN CONDITIONING - EMOLLIENT

HAIR CONDITIONING

InChI

1S/C30H50/c1-25(2)15-11-19-29(7)23-13-21-27(5)17-9-10-18-28(6)22-14-24-30(8)20-12-16-26(3)4/h15-18,23-24H,9-14,19-22H2,1-8H3/b27-17+,28-18+,29-23+,30-24+

InChIKey

YYGNTYWPHWGJRM-AAJYLUCBSA-N

SMILES

CC(C)=CCCC(C)=CCCC(C)=CCC\C=C(/C)CCC=C(C)CCC=C(C)C

LogP

14.12 at 24℃

CAS DataBase Reference

111-02-4(CAS DataBase Reference)

NIST Chemistry Reference

2,6,10,14,18,22-Tetracosahexaene, 2,6,10,15,19,23-hexamethyl-, (all-E)-(111-02-4)

EPA Substance Registry System

Squalene (111-02-4)

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