Cholestanol acetate
TL;DR: Cholestanol acetate (CAS 1255-88-5) is a chemical compound with molecular formula C29H50O2 and molecular weight 430.38 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)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate
Also Known As: Cholestanol acetate, Cholestan-3-yl acetate, Cholestan-3-yl acetate #, Cholestan-3.alpha.-ol acetate, 2-Amino-5-phenyl-thiophene-3-carboxylic acid
| Molecular Formula | C29H50O2 |
|---|---|
| Molecular Weight | 430.38 g/mol |
| LogP | 9.9 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 430.38107 |
| Heavy Atoms | 31 |
| Complexity | 641.0 |
Chemical Identifiers
| CAS Number | 1255-88-5 |
|---|---|
| SMILES | CC(C)CCCC(C)C1CCC2C1(CCC3C2CCC4C3(CCC(C4)OC(=O)C)C)C |
| InChIKey | PHLIUSDPFOUISN-UHFFFAOYSA-N |
Product Overview
Cholestanol acetate (CAS 1255-88-5), with molecular formula C29H50O2 and molecular weight 430.38 g/mol. IUPAC: [10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate.
Chemical Property Profile of Cholestanol acetate
Property Insights of Cholestanol acetate
The XLogP value of 9.9 indicates that Cholestanol 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, Cholestanol acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cholestanol 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 Cholestanol acetate?
The CAS number of Cholestanol acetate is 1255-88-5.
What is the molecular formula of Cholestanol acetate?
The molecular formula of Cholestanol acetate is C29H50O2.
What is the molecular weight of Cholestanol acetate?
The molecular weight of Cholestanol acetate is 430.38 g/mol.
Where can I buy Cholestanol acetate?
You can request a quote for Cholestanol acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cholestanol acetate?
Yes, KEHONG BIO provides custom synthesis services for Cholestanol acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.