Ethylene brassylate
TL;DR: Ethylene brassylate (CAS 105-95-3) is a chemical compound with molecular formula C15H26O4 and molecular weight 270.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-dioxacycloheptadecane-5,17-dione
Also Known As: Ethylene brassylate, 1,4-DIOXACYCLOHEPTADECANE-5,17-DIONE, Astratone, Musk T, Ethyl brassylate
| Molecular Formula | C15H26O4 |
|---|---|
| Molecular Weight | 270.18 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 270.1831 |
| Heavy Atoms | 19 |
| Complexity | 237.0 |
| Melting Point | 0 - 7 °C |
| Boiling Point | 138.00 to 142.00 °C. @ 1.00 mm Hg |
| Density | 1.040-1.045 |
| Solubility | insoluble in water; soluble in alcohol |
| Refractive Index | 1.468-1.474 |
Chemical Identifiers
| CAS Number | 105-95-3 |
|---|---|
| SMILES | C1CCCCCC(=O)OCCOC(=O)CCCCC1 |
| InChIKey | XRHCAGNSDHCHFJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethylene brassylate (CAS 105-95-3), with molecular formula C15H26O4 and molecular weight 270.18 g/mol. IUPAC: 1,4-dioxacycloheptadecane-5,17-dione.
Chemical Property Profile of Ethylene brassylate
Property Insights of Ethylene brassylate
The XLogP value of 4.2 indicates that Ethylene brassylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Ethylene brassylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethylene brassylate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethylene brassylate?
The CAS number of Ethylene brassylate is 105-95-3.
What is the molecular formula of Ethylene brassylate?
The molecular formula of Ethylene brassylate is C15H26O4.
What is the molecular weight of Ethylene brassylate?
The molecular weight of Ethylene brassylate is 270.18 g/mol.
Where can I buy Ethylene brassylate?
You can request a quote for Ethylene brassylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethylene brassylate?
Yes, KEHONG BIO provides custom synthesis services for Ethylene brassylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.