4'-Bromobenzo-15-crown 5-Ether
TL;DR: 4'-Bromobenzo-15-crown 5-Ether (CAS 60835-72-5) is a chemical compound with molecular formula C14H19BrO5 and molecular weight 346.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
17-bromo-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-triene
Also Known As: 4'-Bromobenzo-15-crown 5-Ether, m-Bromobenzo-15-crown-5, KUROMANINCHLORIDE, 4'-Bromobenzo-15-crown-5, 4-BROMOBENZO-15-CROWN 5-ETHER
| Molecular Formula | C14H19BrO5 |
|---|---|
| Molecular Weight | 346.04 g/mol |
| LogP | 2.2701 |
| Topological Polar Surface Area | 46.15 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 346.0416 |
| Heavy Atoms | 20 |
| Complexity | 399.1507 |
Chemical Identifiers
| CAS Number | 60835-72-5 |
|---|---|
| SMILES | C1COCCOC2=C(C=C(C=C2)Br)OCCOCCO1 |
Product Overview
4'-Bromobenzo-15-crown 5-Ether (CAS 60835-72-5), with molecular formula C14H19BrO5 and molecular weight 346.04 g/mol. IUPAC: 17-bromo-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-triene.
Chemical Property Profile of 4'-Bromobenzo-15-crown 5-Ether
Property Insights of 4'-Bromobenzo-15-crown 5-Ether
The XLogP value of 2.2701 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4'-Bromobenzo-15-crown 5-Ether. With a topological polar surface area (TPSA) of 46.15 Ų, 4'-Bromobenzo-15-crown 5-Ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4'-Bromobenzo-15-crown 5-Ether has 0 hydrogen bond donor(s) and 5 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 4'-Bromobenzo-15-crown 5-Ether?
The CAS number of 4'-Bromobenzo-15-crown 5-Ether is 60835-72-5.
What is the molecular formula of 4'-Bromobenzo-15-crown 5-Ether?
The molecular formula of 4'-Bromobenzo-15-crown 5-Ether is C14H19BrO5.
What is the molecular weight of 4'-Bromobenzo-15-crown 5-Ether?
The molecular weight of 4'-Bromobenzo-15-crown 5-Ether is 346.04 g/mol.
Where can I buy 4'-Bromobenzo-15-crown 5-Ether?
You can request a quote for 4'-Bromobenzo-15-crown 5-Ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4'-Bromobenzo-15-crown 5-Ether?
Yes, KEHONG BIO provides custom synthesis services for 4'-Bromobenzo-15-crown 5-Ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.