Cholest-5-en-3-yl acetate
TL;DR: Cholest-5-en-3-yl acetate (CAS 6637-46-3) is a chemical compound with molecular formula C29H48O2 and molecular weight 428.37 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate
Also Known As: Cholesteryl acetate, Cholesterol acetate, Cholesterin acetate, Cholesterylacetate, Cholest-5-en-3-yl acetate
| Molecular Formula | C29H48O2 |
|---|---|
| Molecular Weight | 428.37 g/mol |
| LogP | 9.1 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 428.36542 |
| Heavy Atoms | 31 |
| Complexity | 693.0 |
Chemical Identifiers
| CAS Number | 6637-46-3 |
|---|---|
| SMILES | CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)C)C)C |
| InChIKey | XUGISPSHIFXEHZ-UHFFFAOYSA-N |
Product Overview
Cholest-5-en-3-yl acetate (CAS 6637-46-3), with molecular formula C29H48O2 and molecular weight 428.37 g/mol. IUPAC: [10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate.
Chemical Property Profile of Cholest-5-en-3-yl acetate
Property Insights of Cholest-5-en-3-yl acetate
The XLogP value of 9.1 indicates that Cholest-5-en-3-yl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Cholest-5-en-3-yl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cholest-5-en-3-yl acetate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Cholest-5-en-3-yl acetate?
The CAS number of Cholest-5-en-3-yl acetate is 6637-46-3.
What is the molecular formula of Cholest-5-en-3-yl acetate?
The molecular formula of Cholest-5-en-3-yl acetate is C29H48O2.
What is the molecular weight of Cholest-5-en-3-yl acetate?
The molecular weight of Cholest-5-en-3-yl acetate is 428.37 g/mol.
Where can I buy Cholest-5-en-3-yl acetate?
You can request a quote for Cholest-5-en-3-yl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cholest-5-en-3-yl acetate?
Yes, KEHONG BIO provides custom synthesis services for Cholest-5-en-3-yl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.