(5S,6S)-5,6,8,9,10,11-Hexahydrobenzo(b)phenanthrene-5,6-diol
TL;DR: (5S,6S)-5,6,8,9,10,11-Hexahydrobenzo(b)phenanthrene-5,6-diol (CAS 94850-01-8) is a chemical compound with molecular formula C18H18O2 and molecular weight 266.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5S,6S)-5,6,8,9,10,11-hexahydrobenzo[a]anthracene-5,6-diol
Also Known As: 5,6,8,9,10,11-Hexahydrotetraphene-5,6-diol, (5s,6s)-5,6,8,9,10,11-hexahydrotetraphene-5,6-diol, (5S,6S)-5,6,8,9,10,11-Hexahydrobenzo(b)phenanthrene-5,6-diol, (5s,6r)-5,6,8,9,10,11-hexahydrobenzo(b)phenanthrene-5,6-diol, (5S,6S)-5,6,8,9,10,11-hexahydrobenzo[a]anthracene-5,6-diol
| Molecular Formula | C18H18O2 |
|---|---|
| Molecular Weight | 266.13 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 266.13068 |
| Heavy Atoms | 20 |
| Complexity | 355.0 |
Chemical Identifiers
| CAS Number | 94850-01-8 |
|---|---|
| SMILES | C1CCC2=CC3=C(C=C2C1)[C@@H]([C@H](C4=CC=CC=C43)O)O |
| InChIKey | FFUWBLODZCSJND-ROUUACIJSA-N |
Product Overview
(5S,6S)-5,6,8,9,10,11-Hexahydrobenzo(b)phenanthrene-5,6-diol (CAS 94850-01-8), with molecular formula C18H18O2 and molecular weight 266.13 g/mol. IUPAC: (5S,6S)-5,6,8,9,10,11-hexahydrobenzo[a]anthracene-5,6-diol.
Chemical Property Profile of (5S,6S)-5,6,8,9,10,11-Hexahydrobenzo(b)phenanthrene-5,6-diol
Property Insights of (5S,6S)-5,6,8,9,10,11-Hexahydrobenzo(b)phenanthrene-5,6-diol
The XLogP value of 3.0 indicates that (5S,6S)-5,6,8,9,10,11-Hexahydrobenzo(b)phenanthrene-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, (5S,6S)-5,6,8,9,10,11-Hexahydrobenzo(b)phenanthrene-5,6-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (5S,6S)-5,6,8,9,10,11-Hexahydrobenzo(b)phenanthrene-5,6-diol has 2 hydrogen bond donor(s) and 2 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 (5S,6S)-5,6,8,9,10,11-Hexahydrobenzo(b)phenanthrene-5,6-diol?
The CAS number of (5S,6S)-5,6,8,9,10,11-Hexahydrobenzo(b)phenanthrene-5,6-diol is 94850-01-8.
What is the molecular formula of (5S,6S)-5,6,8,9,10,11-Hexahydrobenzo(b)phenanthrene-5,6-diol?
The molecular formula of (5S,6S)-5,6,8,9,10,11-Hexahydrobenzo(b)phenanthrene-5,6-diol is C18H18O2.
What is the molecular weight of (5S,6S)-5,6,8,9,10,11-Hexahydrobenzo(b)phenanthrene-5,6-diol?
The molecular weight of (5S,6S)-5,6,8,9,10,11-Hexahydrobenzo(b)phenanthrene-5,6-diol is 266.13 g/mol.
Where can I buy (5S,6S)-5,6,8,9,10,11-Hexahydrobenzo(b)phenanthrene-5,6-diol?
You can request a quote for (5S,6S)-5,6,8,9,10,11-Hexahydrobenzo(b)phenanthrene-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 (5S,6S)-5,6,8,9,10,11-Hexahydrobenzo(b)phenanthrene-5,6-diol?
Yes, KEHONG BIO provides custom synthesis services for (5S,6S)-5,6,8,9,10,11-Hexahydrobenzo(b)phenanthrene-5,6-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.