7-Ethylbenz(a)anthracene 5,6-oxide
TL;DR: 7-Ethylbenz(a)anthracene 5,6-oxide (CAS 159714-85-9) is a chemical compound with molecular formula C20H14O and molecular weight 270.10446 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
19-ethyl-3-oxapentacyclo[9.8.0.02,4.05,10.013,18]nonadeca-1(19),2(4),5,7,9,11,13,15,17-nonaene
Also Known As: 7-Ethylbenz(a)anthracene 5,6-oxide, 11-Ethyltetrapheno[5,6-b]oxirene, 7-ETHYLBENZ[A]ANTHRACENE 5,6-OXIDE, CCRIS 7165
Technical Specifications
| Molecular Formula | C20H14O |
| Molecular Weight | 270.10446 g/mol |
| XLogP | 5.1 |
| Topological Polar Surface Area (TPSA) | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 270.10446 Da |
| Heavy Atoms | 21 |
| Complexity | 405.0 |
| SMILES | CCC1=C2C(=CC3=CC=CC=C31)C4=CC=CC=C4C5=C2O5 |
| InChIKey | WSCVEPVXTLLUFT-UHFFFAOYSA-N |
Chemical Property Profile of 7-Ethylbenz(a)anthracene 5,6-oxide
Property Insights of 7-Ethylbenz(a)anthracene 5,6-oxide
The XLogP value of 5.1 indicates that 7-Ethylbenz(a)anthracene 5,6-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, 7-Ethylbenz(a)anthracene 5,6-oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Ethylbenz(a)anthracene 5,6-oxide has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 7-Ethylbenz(a)anthracene 5,6-oxide?
The CAS number of 7-Ethylbenz(a)anthracene 5,6-oxide is 159714-85-9.
What is the molecular formula of 7-Ethylbenz(a)anthracene 5,6-oxide?
The molecular formula of 7-Ethylbenz(a)anthracene 5,6-oxide is C20H14O.
What is the molecular weight of 7-Ethylbenz(a)anthracene 5,6-oxide?
The molecular weight of 7-Ethylbenz(a)anthracene 5,6-oxide is 270.10446 g/mol.
Where can I buy 7-Ethylbenz(a)anthracene 5,6-oxide?
You can request a quote for 7-Ethylbenz(a)anthracene 5,6-oxide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 7-Ethylbenz(a)anthracene 5,6-oxide?
Yes, CoreyChem provides custom synthesis services for 7-Ethylbenz(a)anthracene 5,6-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.