Cholest-5-en-15-yl 4-chlorobutanoate
TL;DR: Cholest-5-en-15-yl 4-chlorobutanoate (CAS 73112-99-9) is a chemical compound with molecular formula C31H51ClO2 and molecular weight 490.36 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(8R,9S,10S,13S,14R,15S,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-15-yl] 4-chlorobutanoate
Also Known As: Cholest-5-en-15-yl 4-chlorobutanoate, Cholest-5-en-3-ol (3beta)-, 4-chlorobutanoate, 10alpha,13alpha,14beta-Cholest-5-en-15alpha-yl 4-chlorobutanoate, [(8R,9S,10S,13S,14R,15S,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-15-yl] 4-chlorobutanoate
| Molecular Formula | C31H51ClO2 |
|---|---|
| Molecular Weight | 490.36 g/mol |
| LogP | 8.9586 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Exact Mass | 490.35776 |
| Heavy Atoms | 34 |
| Complexity | 743.714 |
Chemical Identifiers
| CAS Number | 73112-99-9 |
|---|---|
| SMILES | C[C@H](CCCC(C)C)[C@H]1C[C@@H]([C@H]2[C@]1(CC[C@H]3[C@H]2CC=C4[C@]3(CCCC4)C)C)OC(=O)CCCCl |
Product Overview
Cholest-5-en-15-yl 4-chlorobutanoate (CAS 73112-99-9), with molecular formula C31H51ClO2 and molecular weight 490.36 g/mol. IUPAC: [(8R,9S,10S,13S,14R,15S,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-15-yl] 4-chlorobutanoate.
Chemical Property Profile of Cholest-5-en-15-yl 4-chlorobutanoate
Property Insights of Cholest-5-en-15-yl 4-chlorobutanoate
The XLogP value of 8.9586 indicates that Cholest-5-en-15-yl 4-chlorobutanoate 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-15-yl 4-chlorobutanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cholest-5-en-15-yl 4-chlorobutanoate 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-15-yl 4-chlorobutanoate?
The CAS number of Cholest-5-en-15-yl 4-chlorobutanoate is 73112-99-9.
What is the molecular formula of Cholest-5-en-15-yl 4-chlorobutanoate?
The molecular formula of Cholest-5-en-15-yl 4-chlorobutanoate is C31H51ClO2.
What is the molecular weight of Cholest-5-en-15-yl 4-chlorobutanoate?
The molecular weight of Cholest-5-en-15-yl 4-chlorobutanoate is 490.36 g/mol.
Where can I buy Cholest-5-en-15-yl 4-chlorobutanoate?
You can request a quote for Cholest-5-en-15-yl 4-chlorobutanoate 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-15-yl 4-chlorobutanoate?
Yes, KEHONG BIO provides custom synthesis services for Cholest-5-en-15-yl 4-chlorobutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.