次联苯甲酮
TL;DR: 次联苯甲酮 (CAS 548-39-0) is a chemical compound with molecular formula C13H8O and molecular weight 180.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
次联苯甲酮
phenalen-1-one
Also Known As: Phenalen-1-one, PERINAPHTHENONE, 1H-Phenalen-1-one, Phenalenone, Phenalone
| Molecular Formula | C13H8O |
|---|---|
| Molecular Weight | 180.06 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 180.05751 |
| Heavy Atoms | 14 |
| Complexity | 279.0 |
Chemical Identifiers
| CAS Number | 548-39-0 |
|---|---|
| SMILES | C1=CC2=C3C(=C1)C=CC(=O)C3=CC=C2 |
| InChIKey | WWBGWPHHLRSTFI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
次联苯甲酮 (CAS 548-39-0), with molecular formula C13H8O and molecular weight 180.06 g/mol. IUPAC: phenalen-1-one.
Chemical Property Profile of 次联苯甲酮
Property Insights of 次联苯甲酮
The XLogP value of 3.2 indicates that 次联苯甲酮 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 次联苯甲酮 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 次联苯甲酮 has 0 hydrogen bond donor(s) and 1 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 次联苯甲酮?
The CAS number of 次联苯甲酮 is 548-39-0.
What is the molecular formula of 次联苯甲酮?
The molecular formula of 次联苯甲酮 is C13H8O.
What is the molecular weight of 次联苯甲酮?
The molecular weight of 次联苯甲酮 is 180.06 g/mol.
Where can I buy 次联苯甲酮?
You can request a quote for 次联苯甲酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 次联苯甲酮?
Yes, KEHONG BIO provides custom synthesis services for 次联苯甲酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.