Structure

Cholesteryl Stearate

CAS
35602-69-8
Catalog Number
ACM35602698
Category
Organic & Printed Electronics; Cholesteryl Esters
Molecular Weight
653.12
Molecular Formula
C45H80O2

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Specification

Synonyms
Stearic acid cholesterol ester
IUPAC Name
[(3S,8S,9S,10R,13R,14S,17R)-10,13-Dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] octadecanoate
Canonical SMILES
CCCCCCCCCCCCCCCCCC(=O)OC1CCC2(C3CCC4(C(C3CC=C2C1)CCC4C(C)CCCC(C)C)C)C
InChI
InChI=1S/C45H80O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25-43(46)47-38-30-32-44(5)37(34-38)26-27-39-41-29-28-40(36(4)24-22-23-35(2)3)45(41,6)33-31-42(39)44/h26,35-36,38-42H,7-25,27-34H2,1-6H3/t36-,38+,39+,40-,41+,42+,44+,45-/m1/s1
InChI Key
XHRPOTDGOASDJS-XNTGVSEISA-N
Boiling Point
619.01 °C
Melting Point
79-83 °C(lit.)
Flash Point
360.6 °C
Density
0.9226 g/cm³
Solubility
Insoluble in water
Appearance
Solid
Storage
−20 °C
Active Content
95%
Assay
0.98
CNo.Chain
C18:0
Complexity
934
Compound Derivative
Stearate
Exact Mass
652.61583179
Isomeric SMILES
CCCCCCCCCCCCCCCCCC(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3CC=C2C1)CC[C@@H]4[C@H](C)CCCC(C)C)C)C
Monoisotopic Mass
652.61583179
Packaging
1 kg
Physical State
Solid
Refractive Index
1.505
Safety Description
S24/25
Stability
Stable under normal temperatures and pressures.
Storage Conditions
-20°C
Topological Polar Surface Area
26.3 Ų
What is the CAS number of Cholesteryl Stearate?

The CAS number of Cholesteryl Stearate is 35602-69-8.

What is the molecular weight of Cholesteryl Stearate?

The molecular weight of Cholesteryl Stearate is 653.12.

Can you provide the molecular formula of Cholesteryl Stearate?

The molecular formula of Cholesteryl Stearate is C45H80O2.

What is the boiling point of Cholesteryl Stearate?

The boiling point of Cholesteryl Stearate is 619 °C.

How is Cholesteryl Stearate used in applications?

Cholesteryl Stearate is used as a lubricant, dispersing agent, and emulsion stabilizer.

What is the appearance of Cholesteryl Stearate?

Cholesteryl Stearate appears as a white powder.

What is the purity of Cholesteryl Stearate?

The purity of Cholesteryl Stearate is 97%.

Can you describe the physical state of Cholesteryl Stearate?

Cholesteryl Stearate is in the solid physical state.

How do the actives in Cholesteryl Stearate percentage compare to the purity of the compound?

The actives in Cholesteryl Stearate are 95%, while the purity is 97%.

What is the IUPAC name of Cholesteryl Stearate?

The IUPAC name of Cholesteryl Stearate is [(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] octadecanoate.

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