Kelevan
TL;DR: Kelevan (CAS 4234-79-1) is a chemical compound with molecular formula C17H12Cl10O4 and molecular weight 629.76 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-(1,2,3,4,6,7,8,9,10,10-decachloro-5-hydroxy-5-pentacyclo[5.3.0.02,6.03,9.04,8]decanyl)-4-oxopentanoate
Also Known As: KELEVAN, Despirol, Elevat, Kelevan [ISO], Allied GC 9160
| Molecular Formula | C17H12Cl10O4 |
|---|---|
| Molecular Weight | 629.76 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 633.75616 |
| Heavy Atoms | 31 |
| Complexity | 900.0 |
Chemical Identifiers
| CAS Number | 4234-79-1 |
|---|---|
| SMILES | CCOC(=O)CCC(=O)CC1(C2(C3(C4(C1(C5(C2(C3(C(C45Cl)(Cl)Cl)Cl)Cl)Cl)Cl)Cl)Cl)Cl)O |
| InChIKey | POSKOXIJDWDKPH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Kelevan (CAS 4234-79-1), with molecular formula C17H12Cl10O4 and molecular weight 629.76 g/mol. IUPAC: ethyl 5-(1,2,3,4,6,7,8,9,10,10-decachloro-5-hydroxy-5-pentacyclo[5.3.0.02,6.03,9.04,8]decanyl)-4-oxopentanoate.
Chemical Property Profile of Kelevan
Property Insights of Kelevan
The XLogP value of 3.6 indicates that Kelevan is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Kelevan. Following Lipinski's Rule of Five, Kelevan has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Kelevan?
The CAS number of Kelevan is 4234-79-1.
What is the molecular formula of Kelevan?
The molecular formula of Kelevan is C17H12Cl10O4.
What is the molecular weight of Kelevan?
The molecular weight of Kelevan is 629.76 g/mol.
Where can I buy Kelevan?
You can request a quote for Kelevan directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Kelevan?
Yes, KEHONG BIO provides custom synthesis services for Kelevan and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.