13H-Dibenzo[b,i]xanthen-13-one
TL;DR: 13H-Dibenzo[b,i]xanthen-13-one (CAS 7468-94-2) is a chemical compound with molecular formula C21H12O2 and molecular weight 296.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-oxapentacyclo[12.8.0.03,12.05,10.016,21]docosa-1(22),3,5,7,9,11,14,16,18,20-decaen-13-one
Also Known As: 13H-Dibenzo[b,i]xanthen-13-one, 2-Oxapentacyclo[12.8.0.03,12.05,10.016,21]docosa-1(22),3,5,7,9,11,14,16,18,20-decaen-13-one
| Molecular Formula | C21H12O2 |
|---|---|
| Molecular Weight | 296.08 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 296.08374 |
| Heavy Atoms | 23 |
| Complexity | 432.0 |
Chemical Identifiers
| CAS Number | 7468-94-2 |
|---|---|
| SMILES | C1=CC=C2C=C3C(=CC2=C1)C(=O)C4=CC5=CC=CC=C5C=C4O3 |
| InChIKey | RGHYKWNUBSZRRX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
13H-Dibenzo[b,i]xanthen-13-one (CAS 7468-94-2), with molecular formula C21H12O2 and molecular weight 296.08 g/mol. IUPAC: 2-oxapentacyclo[12.8.0.03,12.05,10.016,21]docosa-1(22),3,5,7,9,11,14,16,18,20-decaen-13-one.
Chemical Property Profile of 13H-Dibenzo[b,i]xanthen-13-one
Property Insights of 13H-Dibenzo[b,i]xanthen-13-one
The XLogP value of 5.5 indicates that 13H-Dibenzo[b,i]xanthen-13-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, 13H-Dibenzo[b,i]xanthen-13-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 13H-Dibenzo[b,i]xanthen-13-one has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 13H-Dibenzo[b,i]xanthen-13-one?
The CAS number of 13H-Dibenzo[b,i]xanthen-13-one is 7468-94-2.
What is the molecular formula of 13H-Dibenzo[b,i]xanthen-13-one?
The molecular formula of 13H-Dibenzo[b,i]xanthen-13-one is C21H12O2.
What is the molecular weight of 13H-Dibenzo[b,i]xanthen-13-one?
The molecular weight of 13H-Dibenzo[b,i]xanthen-13-one is 296.08 g/mol.
Where can I buy 13H-Dibenzo[b,i]xanthen-13-one?
You can request a quote for 13H-Dibenzo[b,i]xanthen-13-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 13H-Dibenzo[b,i]xanthen-13-one?
Yes, KEHONG BIO provides custom synthesis services for 13H-Dibenzo[b,i]xanthen-13-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.