Structure

Cholesteryl caprate

CAS
1183-04-6
Catalog Number
ACM1183046
Category
Steroidal Compounds; Cholesteryl Esters
Molecular Weight
540.9
Molecular Formula
C37H64O2

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Specification

Synonyms
(3β)-cholest-5-en-3-yldecanoate
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]decanoate
Canonical SMILES
CCCCCCCCCC(=O)OC1CCC2(C3CCC4(C(C3CC=C2C1)CCC4C(C)CCCC(C)C)C)C
InChI Key
LJGMGXXCKVFFIS-IATSNXCDSA-N
Boiling Point
587.5ºC at 760mmHg
Flash Point
307.8ºC
Density
0.96g/cm³
Appearance
Powder to crystal
Storage
Freezer
CNo.Chain
C10:0
Compound Derivative
Caprate
EC Number
214-660-4
Exact Mass
540.49100
Physical State
Powder to crystal
WGK Germany
3
What is the molecular formula of Cholesterol decanoate?

The molecular formula of Cholesterol decanoate is C37H64O2.

What are the synonyms for Cholesterol decanoate?

The synonyms for Cholesterol decanoate include Cholesteryl decanoate, Cholesteryl caprate, and Cholesteryl Decanoate (Caprate).

When was Cholesterol decanoate created and last modified?

Cholesterol decanoate was created on October 25, 2006, and last modified on November 25, 2023.

What is the molecular weight of Cholesterol decanoate?

The molecular weight of Cholesterol decanoate is 540.9 g/mol.

What is the IUPAC Name of Cholesterol decanoate?

The IUPAC Name of Cholesterol decanoate 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] decanoate.

What is the InChIKey of Cholesterol decanoate?

The InChIKey of Cholesterol decanoate is LJGMGXXCKVFFIS-IATSNXCDSA-N.

How many hydrogen bond donor counts does Cholesterol decanoate have?

Cholesterol decanoate has 0 hydrogen bond donor counts.

What is the topological polar surface area of Cholesterol decanoate?

The topological polar surface area of Cholesterol decanoate is 26.3Ų.

How many rotatable bond counts does Cholesterol decanoate have?

Cholesterol decanoate has 15 rotatable bond counts.

What is the complexity value of Cholesterol decanoate?

The complexity value of Cholesterol decanoate is 812.

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