5H-Phenanthro(4,5-bcd)pyran-5-one
TL;DR: 5H-Phenanthro(4,5-bcd)pyran-5-one (CAS 27161-64-4) is a chemical compound with molecular formula C15H8O2 and molecular weight 220.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-oxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaen-3-one
Also Known As: 4-Oxapyrene-5-one, 5h-phenanthro[4,5-bcd]pyran-5-one, 4-oxa-pyrene-5-one, 5-Phenanthro(4,5-bcd)pyran-5-one, BENZO-1-NAPHTHALIDE
| Molecular Formula | C15H8O2 |
|---|---|
| Molecular Weight | 220.05 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 220.05243 |
| Heavy Atoms | 17 |
| Complexity | 338.0 |
Chemical Identifiers
| CAS Number | 27161-64-4 |
|---|---|
| SMILES | C1=CC2=C3C(=C1)C(=O)OC4=CC=CC(=C43)C=C2 |
| InChIKey | SJXDHZGVKPNCHK-UHFFFAOYSA-N |
Product Overview
5H-Phenanthro(4,5-bcd)pyran-5-one (CAS 27161-64-4), with molecular formula C15H8O2 and molecular weight 220.05 g/mol. IUPAC: 2-oxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),9,11(15),12-heptaen-3-one.
Chemical Property Profile of 5H-Phenanthro(4,5-bcd)pyran-5-one
Property Insights of 5H-Phenanthro(4,5-bcd)pyran-5-one
The XLogP value of 3.9 indicates that 5H-Phenanthro(4,5-bcd)pyran-5-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 5H-Phenanthro(4,5-bcd)pyran-5-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5H-Phenanthro(4,5-bcd)pyran-5-one has 0 hydrogen bond donor(s) and 2 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 5H-Phenanthro(4,5-bcd)pyran-5-one?
The CAS number of 5H-Phenanthro(4,5-bcd)pyran-5-one is 27161-64-4.
What is the molecular formula of 5H-Phenanthro(4,5-bcd)pyran-5-one?
The molecular formula of 5H-Phenanthro(4,5-bcd)pyran-5-one is C15H8O2.
What is the molecular weight of 5H-Phenanthro(4,5-bcd)pyran-5-one?
The molecular weight of 5H-Phenanthro(4,5-bcd)pyran-5-one is 220.05 g/mol.
Where can I buy 5H-Phenanthro(4,5-bcd)pyran-5-one?
You can request a quote for 5H-Phenanthro(4,5-bcd)pyran-5-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5H-Phenanthro(4,5-bcd)pyran-5-one?
Yes, KEHONG BIO provides custom synthesis services for 5H-Phenanthro(4,5-bcd)pyran-5-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.