Disparlure
TL;DR: Disparlure (CAS 29804-22-6) is a chemical compound with molecular formula C19H38O and molecular weight 282.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3S)-2-decyl-3-(5-methylhexyl)oxirane
Also Known As: Disparlure, Atralymon, Epoxan, (-)-Disparlure, (+/-)-Disparlure
| Molecular Formula | C19H38O |
|---|---|
| Molecular Weight | 282.29 g/mol |
| LogP | 8.2 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 14 |
| Exact Mass | 282.29227 |
| Heavy Atoms | 20 |
| Complexity | 212.0 |
Chemical Identifiers
| CAS Number | 29804-22-6 |
|---|---|
| SMILES | CCCCCCCCCC[C@@H]1[C@@H](O1)CCCCC(C)C |
| InChIKey | HFOFYNMWYRXIBP-MOPGFXCFSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Disparlure (CAS 29804-22-6), with molecular formula C19H38O and molecular weight 282.29 g/mol. IUPAC: (2R,3S)-2-decyl-3-(5-methylhexyl)oxirane.
Chemical Property Profile of Disparlure
Property Insights of Disparlure
The XLogP value of 8.2 indicates that Disparlure is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.5 Ų, Disparlure exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Disparlure has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Disparlure?
The CAS number of Disparlure is 29804-22-6.
What is the molecular formula of Disparlure?
The molecular formula of Disparlure is C19H38O.
What is the molecular weight of Disparlure?
The molecular weight of Disparlure is 282.29 g/mol.
Where can I buy Disparlure?
You can request a quote for Disparlure directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Disparlure?
Yes, KEHONG BIO provides custom synthesis services for Disparlure and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.