Cholesteryl caprylate
TL;DR: Cholesteryl caprylate (CAS 1182-42-9) is a chemical compound with molecular formula C35H60O2 and molecular weight 512.45935 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(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] octanoate
Also Known As: Cholesteryl caprylate, Cholesteryl octanoate, Cholesterol n-Octanoate, cholesterol caprylate, cholesterol octanoate
Application Areas
Top 5 of 10 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C35H60O2 |
| Molecular Weight | 512.45935 g/mol |
| XLogP | 12.1 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 13 |
| Exact Mass | 512.45935 Da |
| Heavy Atoms | 37 |
| Complexity | 782.0 |
| SMILES | CCCCCCCC(=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 |
| InChIKey | SKLBBRQPVZDTNM-SJTWHRLHSA-N |
Chemical Property Profile of Cholesteryl caprylate
Property Insights of Cholesteryl caprylate
The XLogP value of 12.1 indicates that Cholesteryl caprylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Cholesteryl caprylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cholesteryl caprylate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Cholesteryl caprylate?
The CAS number of Cholesteryl caprylate is 1182-42-9.
What is the molecular formula of Cholesteryl caprylate?
The molecular formula of Cholesteryl caprylate is C35H60O2.
What is the molecular weight of Cholesteryl caprylate?
The molecular weight of Cholesteryl caprylate is 512.45935 g/mol.
Where can I buy Cholesteryl caprylate?
You can request a quote for Cholesteryl caprylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Cholesteryl caprylate?
Yes, CoreyChem provides custom synthesis services for Cholesteryl caprylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.