Dibenz(a,h)anthracene-5,6-diol
TL;DR: Dibenz(a,h)anthracene-5,6-diol (CAS 3719-40-2) is a chemical compound with molecular formula C22H16O2 and molecular weight 312.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5R,6R)-5,6-dihydronaphtho[1,2-b]phenanthrene-5,6-diol
Also Known As: Dibenz(a,h)anthracene-5,6-diol, trans-Dibenz(a,h)anthracene-5,6-dihydrodiol, trans-5,6-Dihydrodibenz(a,h)anthracene-5,6-diol, trans-5,6-Dihydro-5,6-dihydroxydibenz(a,h)anthracene, (-)-trans-5,6-Dihydroxy-5,6-dihydrodibenz(a,h)anthracene
| Molecular Formula | C22H16O2 |
|---|---|
| Molecular Weight | 312.12 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 312.11502 |
| Heavy Atoms | 24 |
| Complexity | 463.0 |
Chemical Identifiers
| CAS Number | 3719-40-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC3=CC4=C(C=C32)[C@H]([C@@H](C5=CC=CC=C54)O)O |
| InChIKey | RDJMBJBJQWPDEA-FGZHOGPDSA-N |
Product Overview
Dibenz(a,h)anthracene-5,6-diol (CAS 3719-40-2), with molecular formula C22H16O2 and molecular weight 312.12 g/mol. IUPAC: (5R,6R)-5,6-dihydronaphtho[1,2-b]phenanthrene-5,6-diol.
Chemical Property Profile of Dibenz(a,h)anthracene-5,6-diol
Property Insights of Dibenz(a,h)anthracene-5,6-diol
The XLogP value of 4.1 indicates that Dibenz(a,h)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, Dibenz(a,h)anthracene-5,6-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dibenz(a,h)anthracene-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 Dibenz(a,h)anthracene-5,6-diol?
The CAS number of Dibenz(a,h)anthracene-5,6-diol is 3719-40-2.
What is the molecular formula of Dibenz(a,h)anthracene-5,6-diol?
The molecular formula of Dibenz(a,h)anthracene-5,6-diol is C22H16O2.
What is the molecular weight of Dibenz(a,h)anthracene-5,6-diol?
The molecular weight of Dibenz(a,h)anthracene-5,6-diol is 312.12 g/mol.
Where can I buy Dibenz(a,h)anthracene-5,6-diol?
You can request a quote for Dibenz(a,h)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 Dibenz(a,h)anthracene-5,6-diol?
Yes, KEHONG BIO provides custom synthesis services for Dibenz(a,h)anthracene-5,6-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.