(5R-trans)-7-Fluoro-5,6-dihydrobenz(a)anthracene-5,6-diol
TL;DR: (5R-trans)-7-Fluoro-5,6-dihydrobenz(a)anthracene-5,6-diol (CAS 89577-39-9) is a chemical compound with molecular formula C18H13FO2 and molecular weight 280.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5R,6R)-7-fluoro-5,6-dihydrobenzo[a]anthracene-5,6-diol
Also Known As: (5R-trans)-7-Fluoro-5,6-dihydrobenz(a)anthracene-5,6-diol, 7-Fluoro-5,6-dihydrobenz(a)anthracene-5,6-diol (5R-trans)-, (5R,6R)-7-fluoro-5,6-dihydrobenzo[a]anthracene-5,6-diol, Benz(a)anthracene-5,6-diol, 7-fluoro-5,6-dihydro-, (5R-trans)-
| Molecular Formula | C18H13FO2 |
|---|---|
| Molecular Weight | 280.09 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 280.08997 |
| Heavy Atoms | 21 |
| Complexity | 387.0 |
Chemical Identifiers
| CAS Number | 89577-39-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C3C4=CC=CC=C4[C@H]([C@@H](C3=C2F)O)O |
| InChIKey | IINHRBKUQPQQOY-QZTJIDSGSA-N |
Product Overview
(5R-trans)-7-Fluoro-5,6-dihydrobenz(a)anthracene-5,6-diol (CAS 89577-39-9), with molecular formula C18H13FO2 and molecular weight 280.09 g/mol. IUPAC: (5R,6R)-7-fluoro-5,6-dihydrobenzo[a]anthracene-5,6-diol.
Chemical Property Profile of (5R-trans)-7-Fluoro-5,6-dihydrobenz(a)anthracene-5,6-diol
Property Insights of (5R-trans)-7-Fluoro-5,6-dihydrobenz(a)anthracene-5,6-diol
The XLogP value of 3.0 indicates that (5R-trans)-7-Fluoro-5,6-dihydrobenz(a)anthracene-5,6-diol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, (5R-trans)-7-Fluoro-5,6-dihydrobenz(a)anthracene-5,6-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (5R-trans)-7-Fluoro-5,6-dihydrobenz(a)anthracene-5,6-diol has 2 hydrogen bond donor(s) and 3 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 (5R-trans)-7-Fluoro-5,6-dihydrobenz(a)anthracene-5,6-diol?
The CAS number of (5R-trans)-7-Fluoro-5,6-dihydrobenz(a)anthracene-5,6-diol is 89577-39-9.
What is the molecular formula of (5R-trans)-7-Fluoro-5,6-dihydrobenz(a)anthracene-5,6-diol?
The molecular formula of (5R-trans)-7-Fluoro-5,6-dihydrobenz(a)anthracene-5,6-diol is C18H13FO2.
What is the molecular weight of (5R-trans)-7-Fluoro-5,6-dihydrobenz(a)anthracene-5,6-diol?
The molecular weight of (5R-trans)-7-Fluoro-5,6-dihydrobenz(a)anthracene-5,6-diol is 280.09 g/mol.
Where can I buy (5R-trans)-7-Fluoro-5,6-dihydrobenz(a)anthracene-5,6-diol?
You can request a quote for (5R-trans)-7-Fluoro-5,6-dihydrobenz(a)anthracene-5,6-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5R-trans)-7-Fluoro-5,6-dihydrobenz(a)anthracene-5,6-diol?
Yes, KEHONG BIO provides custom synthesis services for (5R-trans)-7-Fluoro-5,6-dihydrobenz(a)anthracene-5,6-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.