4'-Acetylbenzo-18-crown 6-Ether
TL;DR: 4'-Acetylbenzo-18-crown 6-Ether (CAS 41855-35-0) is a chemical compound with molecular formula C18H26O7 and molecular weight 354.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,5,8,11,14,17-hexaoxabicyclo[16.4.0]docosa-1(18),19,21-trien-20-yl)ethanone
Also Known As: 4'-Acetylbenzo-18-crown 6-Ether, Boc-D-Glu-NH2, 4'-Acetylbenzo-18-crown-6, 4-ACETYLBENZO-18-CROWN 6-ETHER, BENZO18CROWN6ETHERMACETYL
| Molecular Formula | C18H26O7 |
|---|---|
| Molecular Weight | 354.17 g/mol |
| LogP | 1.7268 |
| Topological Polar Surface Area | 72.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 354.16785 |
| Heavy Atoms | 25 |
| Complexity | 518.14606 |
Chemical Identifiers
| CAS Number | 41855-35-0 |
|---|---|
| SMILES | CC(=O)C1=CC2=C(C=C1)OCCOCCOCCOCCOCCO2 |
Product Overview
4'-Acetylbenzo-18-crown 6-Ether (CAS 41855-35-0), with molecular formula C18H26O7 and molecular weight 354.17 g/mol. IUPAC: 1-(2,5,8,11,14,17-hexaoxabicyclo[16.4.0]docosa-1(18),19,21-trien-20-yl)ethanone.
Chemical Property Profile of 4'-Acetylbenzo-18-crown 6-Ether
Property Insights of 4'-Acetylbenzo-18-crown 6-Ether
The XLogP value of 1.7268 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4'-Acetylbenzo-18-crown 6-Ether. The TPSA of 72.45 Ų falls within the moderate polarity range, balancing permeability and solubility for 4'-Acetylbenzo-18-crown 6-Ether. Following Lipinski's Rule of Five, 4'-Acetylbenzo-18-crown 6-Ether has 0 hydrogen bond donor(s) and 7 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'-Acetylbenzo-18-crown 6-Ether?
The CAS number of 4'-Acetylbenzo-18-crown 6-Ether is 41855-35-0.
What is the molecular formula of 4'-Acetylbenzo-18-crown 6-Ether?
The molecular formula of 4'-Acetylbenzo-18-crown 6-Ether is C18H26O7.
What is the molecular weight of 4'-Acetylbenzo-18-crown 6-Ether?
The molecular weight of 4'-Acetylbenzo-18-crown 6-Ether is 354.17 g/mol.
Where can I buy 4'-Acetylbenzo-18-crown 6-Ether?
You can request a quote for 4'-Acetylbenzo-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 4'-Acetylbenzo-18-crown 6-Ether?
Yes, KEHONG BIO provides custom synthesis services for 4'-Acetylbenzo-18-crown 6-Ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.