(8S,9S)-6-fluoro-7-(hydroxymethyl)-12-methyl-8,9-dihydrotetraphene-8,9-diol
TL;DR: (8S,9S)-6-fluoro-7-(hydroxymethyl)-12-methyl-8,9-dihydrotetraphene-8,9-diol (CAS 80752-34-7) is a chemical compound with molecular formula C20H17FO3 and molecular weight 324.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8S,9S)-6-fluoro-7-(hydroxymethyl)-12-methyl-8,9-dihydrobenzo[a]anthracene-8,9-diol
Also Known As: (8S,9S)-6-fluoro-7-(hydroxymethyl)-12-methyl-8,9-dihydrotetraphene-8,9-diol, Benz(a)anthracene-8,9-diol, 6-fluoro-8,9-dihydro-7-(hydroxymethyl)-12-methyl-, trans-, 6-Fluoro-7-(hydroxymethyl)-12-methyl-8,9-dihydrotetraphene-8,9-diol, (8S,9S)-6-fluoro-7-(hydroxymethyl)-12-methyl-8,9-dihydrobenzo[a]anthracene-8,9-diol
| Molecular Formula | C20H17FO3 |
|---|---|
| Molecular Weight | 324.12 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 60.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 324.11618 |
| Heavy Atoms | 24 |
| Complexity | 495.0 |
Chemical Identifiers
| CAS Number | 80752-34-7 |
|---|---|
| SMILES | CC1=C2C=C[C@@H]([C@H](C2=C(C3=C1C4=CC=CC=C4C=C3F)CO)O)O |
| InChIKey | OLPUCCIOMBZYJD-OXJNMPFZSA-N |
Product Overview
(8S,9S)-6-fluoro-7-(hydroxymethyl)-12-methyl-8,9-dihydrotetraphene-8,9-diol (CAS 80752-34-7), with molecular formula C20H17FO3 and molecular weight 324.12 g/mol. IUPAC: (8S,9S)-6-fluoro-7-(hydroxymethyl)-12-methyl-8,9-dihydrobenzo[a]anthracene-8,9-diol.
Chemical Property Profile of (8S,9S)-6-fluoro-7-(hydroxymethyl)-12-methyl-8,9-dihydrotetraphene-8,9-diol
Property Insights of (8S,9S)-6-fluoro-7-(hydroxymethyl)-12-methyl-8,9-dihydrotetraphene-8,9-diol
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (8S,9S)-6-fluoro-7-(hydroxymethyl)-12-methyl-8,9-dihydrotetraphene-8,9-diol. The TPSA of 60.7 Ų falls within the moderate polarity range, balancing permeability and solubility for (8S,9S)-6-fluoro-7-(hydroxymethyl)-12-methyl-8,9-dihydrotetraphene-8,9-diol. Following Lipinski's Rule of Five, (8S,9S)-6-fluoro-7-(hydroxymethyl)-12-methyl-8,9-dihydrotetraphene-8,9-diol has 3 hydrogen bond donor(s) and 4 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 (8S,9S)-6-fluoro-7-(hydroxymethyl)-12-methyl-8,9-dihydrotetraphene-8,9-diol?
The CAS number of (8S,9S)-6-fluoro-7-(hydroxymethyl)-12-methyl-8,9-dihydrotetraphene-8,9-diol is 80752-34-7.
What is the molecular formula of (8S,9S)-6-fluoro-7-(hydroxymethyl)-12-methyl-8,9-dihydrotetraphene-8,9-diol?
The molecular formula of (8S,9S)-6-fluoro-7-(hydroxymethyl)-12-methyl-8,9-dihydrotetraphene-8,9-diol is C20H17FO3.
What is the molecular weight of (8S,9S)-6-fluoro-7-(hydroxymethyl)-12-methyl-8,9-dihydrotetraphene-8,9-diol?
The molecular weight of (8S,9S)-6-fluoro-7-(hydroxymethyl)-12-methyl-8,9-dihydrotetraphene-8,9-diol is 324.12 g/mol.
Where can I buy (8S,9S)-6-fluoro-7-(hydroxymethyl)-12-methyl-8,9-dihydrotetraphene-8,9-diol?
You can request a quote for (8S,9S)-6-fluoro-7-(hydroxymethyl)-12-methyl-8,9-dihydrotetraphene-8,9-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (8S,9S)-6-fluoro-7-(hydroxymethyl)-12-methyl-8,9-dihydrotetraphene-8,9-diol?
Yes, KEHONG BIO provides custom synthesis services for (8S,9S)-6-fluoro-7-(hydroxymethyl)-12-methyl-8,9-dihydrotetraphene-8,9-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.