Benzo-18-crown 6-Ether
TL;DR: Benzo-18-crown 6-Ether (CAS 141365-20-0) is a chemical compound with molecular formula C16H24O6 and molecular weight 312.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5,8,11,14,17-hexaoxabicyclo[16.4.0]docosa-1(22),18,20-triene
Also Known As: Benzo-18-crown-6, Benzo-18-crown 6-Ether, benzo-18-crown-6-ether, B18C6-benzo crown ether, benzo[18]crown-6
| Molecular Formula | C16H24O6 |
|---|---|
| Molecular Weight | 312.16 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 312.1573 |
| Heavy Atoms | 22 |
| Complexity | 237.0 |
Chemical Identifiers
| CAS Number | 141365-20-0 |
|---|---|
| SMILES | C1COCCOCCOC2=CC=CC=C2OCCOCCO1 |
| InChIKey | DSFHXKRFDFROER-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzo-18-crown 6-Ether (CAS 141365-20-0), with molecular formula C16H24O6 and molecular weight 312.16 g/mol. IUPAC: 2,5,8,11,14,17-hexaoxabicyclo[16.4.0]docosa-1(22),18,20-triene.
Chemical Property Profile of Benzo-18-crown 6-Ether
Property Insights of Benzo-18-crown 6-Ether
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzo-18-crown 6-Ether. With a topological polar surface area (TPSA) of 55.4 Ų, Benzo-18-crown 6-Ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzo-18-crown 6-Ether has 0 hydrogen bond donor(s) and 6 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 Benzo-18-crown 6-Ether?
The CAS number of Benzo-18-crown 6-Ether is 141365-20-0.
What is the molecular formula of Benzo-18-crown 6-Ether?
The molecular formula of Benzo-18-crown 6-Ether is C16H24O6.
What is the molecular weight of Benzo-18-crown 6-Ether?
The molecular weight of Benzo-18-crown 6-Ether is 312.16 g/mol.
Where can I buy Benzo-18-crown 6-Ether?
You can request a quote for Benzo-18-crown 6-Ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzo-18-crown 6-Ether?
Yes, KEHONG BIO provides custom synthesis services for Benzo-18-crown 6-Ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.