(3beta)-3-Chlorocholest-5-ene

Basic Information

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CAS Number

910-31-6

Molecular Formula

C27H45Cl

Molecular Weight

405.11 g/mol

Chemical Classification

Polymers and Plastics Thermoplastics Polyolefins

Basic Physical Properties

Melting Point

94.0 to 99.0 deg-C

Boiling Point

488.29°C (rough estimate)

Density

0.9160 (rough estimate)

Flash Point

249.6 °C

Refractive Index

1.6281 (estimate)

Specific Rotation

-30 º (c=1, chloroform)

SMILES

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CC(C)CCC[C@@H](C)[C@H]1CC[C@@]2([H])[C@]3([H])CC=C4CC(Cl)CC[C@]4(C)[C@@]3([H])CC[C@]12C

InChI

InChI=1S/C27H45Cl/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h9,18-19,21-25H,6-8,10-17H2,1-5H3/t19-,21+,22+,23-,24+,25+,26+,27-/m1/s1

InChIKey

OTVRYZXVVMZHHW-DPAQBDIFSA-N

LogP

8.635200000000005

Topological Polar Surface Area

0.0 Å²

Hydrogen Bond Donor/Acceptor

0 / 0

Complexity

591

Synonyms & References

English

Cholesteryl chloride
3-beta-chlorocholest-5-ene
(3beta)-3-chlorocholest-5-ene
Cholesterol chloride
3-chloro-,3.beta.-Cholest-5-ene
Cholest-5-ene, 3beta-chloro-
Cholest-5-ene, 3-chloro-, (3beta)-
Cholest-5-ene,3-chloro,(3β)-
BETA-CHLORO-5-CHOLESTENE
5-CHOLESTEN-3BETA-CHLORIDE
CHOLESTERYL CHLORIDE(RG)
Cholesteryl Chloride froM Beef Fat
3-Chlorocholestene
5-Cholesten-3β-chloride
3beta-Chlorocholest-5-ene
(8S,9R,10R,13R,14S)-3-Chloro-10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-d
(3β)-3-Chlorocholest-5-ene (ACI)
Cholest-5-ene, 3β-chloro- (6CI, 7CI, 8CI)
3β-Chlorocholest-5-ene
3β-Cholesteryl chloride
NSC 2084

MDL Number

MFCD00003632

Customs Code

29035990

FAQ

What is (3beta)-3-Chlorocholest-5-ene (CAS: 910-31-6)?

(3beta)-3-Chlorocholest-5-ene is a cholesterol derivative with a chlorinated side chain. It is a colorless to white crystalline solid with a molecular weight of approximately 324.86 g/mol and a melting point around 50-52°C. This compound is used in various applications including pharmaceuticals and research due to its structural similarity to cholesterol.

What are the main uses of (3beta)-3-Chlorocholest-5-ene (CAS: 910-31-6)?

(3beta)-3-Chlorocholest-5-ene is primarily used in the pharmaceutical and research industries as a starting material for the synthesis of cholesterol-related compounds. It is also utilized in the formulation of certain drug products and as a reagent in biochemical and pharmacological research.

Is (3beta)-3-Chlorocholest-5-ene (CAS: 910-31-6) safe?

(3beta)-3-Chlorocholest-5-ene can be safe under proper handling and storage conditions. However, it is important to follow safety guidelines, such as handling it in a well-ventilated area, wearing appropriate personal protective equipment, and avoiding contact with skin and eyes. It should be stored in a cool, dry place away from direct sunlight and heat sources.

How should (3beta)-3-Chlorocholest-5-ene (CAS: 910-31-6) be stored?

(3beta)-3-Chlorocholest-5-ene should be stored in a cool, dry place away from direct sunlight and heat sources to maintain its stability. It should be kept in a tightly sealed container to prevent moisture absorption. It is advisable to store it at a temperature not exceeding 25°C and to avoid exposure to temperatures above 30°C to ensure its integrity and safety.