4'-Formylbenzo-15-crown-5
TL;DR: 4'-Formylbenzo-15-crown-5 (CAS 60835-73-6) is a chemical compound with molecular formula C15H20O6 and molecular weight 296.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-triene-17-carbaldehyde
Also Known As: 4'-Formylbenzo-15-crown-5, 4'-Formylbenzo-15-crown 5-Ether, 2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-triene-17-carbaldehyde, 4-FORMYLBENZO-15-CROWN 5-ETHER, 4-Formylbenzo-15-crown-5
| Molecular Formula | C15H20O6 |
|---|---|
| Molecular Weight | 296.13 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 63.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 296.12598 |
| Heavy Atoms | 21 |
| Complexity | 285.0 |
Chemical Identifiers
| CAS Number | 60835-73-6 |
|---|---|
| SMILES | C1COCCOC2=C(C=C(C=C2)C=O)OCCOCCO1 |
| InChIKey | MBJIKIAWNPEHOR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4'-Formylbenzo-15-crown-5 (CAS 60835-73-6), with molecular formula C15H20O6 and molecular weight 296.13 g/mol. IUPAC: 2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-triene-17-carbaldehyde.
Chemical Property Profile of 4'-Formylbenzo-15-crown-5
Property Insights of 4'-Formylbenzo-15-crown-5
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4'-Formylbenzo-15-crown-5. The TPSA of 63.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 4'-Formylbenzo-15-crown-5. Following Lipinski's Rule of Five, 4'-Formylbenzo-15-crown-5 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 4'-Formylbenzo-15-crown-5?
The CAS number of 4'-Formylbenzo-15-crown-5 is 60835-73-6.
What is the molecular formula of 4'-Formylbenzo-15-crown-5?
The molecular formula of 4'-Formylbenzo-15-crown-5 is C15H20O6.
What is the molecular weight of 4'-Formylbenzo-15-crown-5?
The molecular weight of 4'-Formylbenzo-15-crown-5 is 296.13 g/mol.
Where can I buy 4'-Formylbenzo-15-crown-5?
You can request a quote for 4'-Formylbenzo-15-crown-5 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4'-Formylbenzo-15-crown-5?
Yes, KEHONG BIO provides custom synthesis services for 4'-Formylbenzo-15-crown-5 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.