Cholesteryl heptanoate
TL;DR: Cholesteryl heptanoate (CAS 1182-07-6) is a chemical compound with molecular formula C34H58O2 and molecular weight 498.4437 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] heptanoate
Also Known As: Cholesteryl heptanoate, Cholesterol Heptanoate, Cholesterol Enanthate, 1-Aminononane, cholesteryl heptylate
Application Areas
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C34H58O2 |
| Molecular Weight | 498.4437 g/mol |
| XLogP | 11.6 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 12 |
| Exact Mass | 498.4437 Da |
| Heavy Atoms | 36 |
| Complexity | 767.0 |
| SMILES | CCCCCCC(=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 | KXWDMNPRHKRGKB-DYQRUOQXSA-N |
Chemical Property Profile of Cholesteryl heptanoate
Property Insights of Cholesteryl heptanoate
The XLogP value of 11.6 indicates that Cholesteryl heptanoate 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 heptanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cholesteryl heptanoate 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 heptanoate?
The CAS number of Cholesteryl heptanoate is 1182-07-6.
What is the molecular formula of Cholesteryl heptanoate?
The molecular formula of Cholesteryl heptanoate is C34H58O2.
What is the molecular weight of Cholesteryl heptanoate?
The molecular weight of Cholesteryl heptanoate is 498.4437 g/mol.
Where can I buy Cholesteryl heptanoate?
You can request a quote for Cholesteryl heptanoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Cholesteryl heptanoate?
Yes, CoreyChem provides custom synthesis services for Cholesteryl heptanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.