ChemicalBook--->CAS DataBase List--->7683-64-9

7683-64-9

7683-64-9 Structure

7683-64-9 Structure
IdentificationBack Directory
[Name]

Squalene
[CAS]

7683-64-9
[Synonyms]

Skvalen
Sqalene
SQUALENE
SPINACENE
Aids017396
Aids-017396
SQUALENE OIL
SQUALENE(SG)
Squalene, purified
Vegetable Squalene
Squalene USP/EP/BP
SQUALENE (OLIVE DERIVED)
Squalene Solution, 100μg/mL
Squalene, spinacene, supraene
2,6,10,15,19,23-HEXAMETHYL-2,6,10,14,18,22-TETRACOSAHEXAENE
2,6,10,14,18,22-Tetracosahexaene, 2,6,10,15,19,23-hexamethyl-
2,6,10,15,19,23-HEXAMETHYL-2, 6, 10, 14, 18, 22-TETRACOSAHEXENE
(6E,10E,14E,18Z)-2,6,10,15,19,23-Hexamethyl-2,6,10,14,18,22-tetracosahexaene
(6E,10E,14Z,18Z)-2,6,10,15,19,23-hexamethyl-tetracosa-2,6,10,14,18,22-hexaene
[EINECS(EC#)]

203-826-1
[Molecular Formula]

C30H50
[MDL Number]

MFCD00008912
[MOL File]

7683-64-9.mol
[Molecular Weight]

410.72
Chemical PropertiesBack Directory
[Melting point ]

−75 °C(lit.)
[Boiling point ]

285 °C25 mm Hg(lit.)
[density ]

0.858 g/mL at 25 °C(lit.)
[refractive index ]

n20/D 1.494(lit.)
[Fp ]

>230 °F
[storage temp. ]

2-8°C
[solubility ]

Chloroform (Slightly), Ethyl Acetate (Slightly)
[form ]

liquid
[color ]

light yellow
[Cosmetics Ingredients Functions]

HAIR CONDITIONING
SKIN CONDITIONING - EMOLLIENT
SOLVENT
[InChI]

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
[InChIKey]

YYGNTYWPHWGJRM-UHFFFAOYSA-N
[SMILES]

C/C(/C)=C\CCC(C)=CCCC(C)=CCCC=C(C)CCC=C(C)CC/C=C(/C)\C
[LogP]

12.188 (est)
[Uses]

squalene is like squalane, squalene replenishes skin lipids while softening and smoothing. It helps maintain the skin in good condition. When used in hair care products, it serves as a hairconditioning and anti-static agent.
[NIST Chemistry Reference]

Squalene(7683-64-9)
[EPA Substance Registry System]

2,6,10,14,18,22Tetracosahexaene, 2,6,10,15,19,23-hexamethyl(7683-64-9)
Safety DataBack Directory
[Safety Statements ]

24/25
[WGK Germany ]

2
[RTECS ]

XB6010000
[F ]

8-10-23
Raw materials And Preparation ProductsBack Directory
[Preparation Products]

Squalene
Hazard InformationBack Directory
[Chemical Properties]

Squalene belongs to the group of triterpenoids. Oily liquid. After absorbing oxygen in the air, it is transformed into viscous liquid resembling linseed oil. Melting point -38 ° C, boiling point 280 ° C (17 mm Hg), specific gravity 0.8128 (15/4 ° C), refractive index 1.4965, in cyclohexane UV λmax < 226 nm. Soluble in ether, petroleum ether, acetone and carbon tetrachloride and other fat-soluble solvents, slightly soluble in ethanol and glacial acetic acid, almost insoluble in water. Has a slight pleasant odor. Decomposes when distilled under normal pressure. Gradually absorbs oxygen and resinates when placed in air.
[Definition]

squalene: An intermediate compoundformed in the synthesis ofcholesterol; it is a hydrocarbon containing30 carbon atoms. The immediateoxidation of squalene tosqualene 2,3-epoxide is the last commonstep in the synthesis of sterolsin animals, plants, and fungi.
[Biological Activity]

Squalene takes part in metabolism as precursor for synthesis of steroids and structurally quite similar to β-carotene, coenzyme q10, vitamins K1, E, and D. As a secosteroid, vitamin D biosynthesis is also regulated by squalene. Moreover, being precursor for each steroid family makes squalene a crucial component of the body.
[Synthesis]

Squalene is generally extracted from shark liver oil by distillation. Pure squalene at atmospheric pressure 350 ° C boiling, and partially decomposed, therefore, must be distilled under reduced pressure, or liver oil direct distillation, or first sapon

Spectrum DetailBack Directory
[Spectrum Detail]

Squalene(7683-64-9)MS
Squalene(7683-64-9)1HNMR
Squalene(7683-64-9)13CNMR
Squalene(7683-64-9)IR1
Squalene(7683-64-9)IR2
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