Benzanthracene-8,9-oxide
TL;DR: Benzanthracene-8,9-oxide (CAS 34501-55-8) is a chemical compound with molecular formula C18H12O and molecular weight 244.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-oxapentacyclo[9.8.0.03,9.04,6.012,17]nonadeca-1,3(9),7,10,12,14,16,18-octaene
Also Known As: Benzanthracene-8,9-oxide, Benz(a)anthracene-8,9-epoxide, Benz(a)anthracene 8,9-oxide, 8,9-epoxybenz(a)anthracene, 10,11-Dihydrobenzanthracen
| Molecular Formula | C18H12O |
|---|---|
| Molecular Weight | 244.09 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 244.08882 |
| Heavy Atoms | 19 |
| Complexity | 400.0 |
Chemical Identifiers
| CAS Number | 34501-55-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC3=CC4=C(C=CC5C4O5)C=C32 |
| InChIKey | SVKZFXAHKUJFBQ-UHFFFAOYSA-N |
Product Overview
Benzanthracene-8,9-oxide (CAS 34501-55-8), with molecular formula C18H12O and molecular weight 244.09 g/mol. IUPAC: 5-oxapentacyclo[9.8.0.03,9.04,6.012,17]nonadeca-1,3(9),7,10,12,14,16,18-octaene.
Chemical Property Profile of Benzanthracene-8,9-oxide
Property Insights of Benzanthracene-8,9-oxide
The XLogP value of 4.3 indicates that Benzanthracene-8,9-oxide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.5 Ų, Benzanthracene-8,9-oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzanthracene-8,9-oxide 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 Benzanthracene-8,9-oxide?
The CAS number of Benzanthracene-8,9-oxide is 34501-55-8.
What is the molecular formula of Benzanthracene-8,9-oxide?
The molecular formula of Benzanthracene-8,9-oxide is C18H12O.
What is the molecular weight of Benzanthracene-8,9-oxide?
The molecular weight of Benzanthracene-8,9-oxide is 244.09 g/mol.
Where can I buy Benzanthracene-8,9-oxide?
You can request a quote for Benzanthracene-8,9-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzanthracene-8,9-oxide?
Yes, KEHONG BIO provides custom synthesis services for Benzanthracene-8,9-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.