7-Hydroxymethylbenz(a)anthracene-8,9-dihydrodiol
TL;DR: 7-Hydroxymethylbenz(a)anthracene-8,9-dihydrodiol (CAS 16053-72-8) is a chemical compound with molecular formula C19H16O3 and molecular weight 292.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(hydroxymethyl)-8,9-dihydrobenzo[a]anthracene-8,9-diol
Also Known As: 7-Ohmba-8,9, 7-Hydroxymethylbenz(a)anthracene-8,9-dihydrodiol, 7-(hydroxymethyl)-8,9-dihydrobenzo[a]anthracene-8,9-diol, Benz(a)anthracene-8,9-diol, 8,9-dihydro-7-(hydroxymethyl)-, 7-(HYDROXYMETHYL)-8,9-DIHYDROTETRAPHENE-8,9-DIOL
| Molecular Formula | C19H16O3 |
|---|---|
| Molecular Weight | 292.11 g/mol |
| LogP | 2.9064 |
| Topological Polar Surface Area | 60.69 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 292.10995 |
| Heavy Atoms | 22 |
| Complexity | 911.3366 |
Chemical Identifiers
| CAS Number | 16053-72-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC3=C2C=C4C=CC(C(C4=C3CO)O)O |
Product Overview
7-Hydroxymethylbenz(a)anthracene-8,9-dihydrodiol (CAS 16053-72-8), with molecular formula C19H16O3 and molecular weight 292.11 g/mol. IUPAC: 7-(hydroxymethyl)-8,9-dihydrobenzo[a]anthracene-8,9-diol.
Chemical Property Profile of 7-Hydroxymethylbenz(a)anthracene-8,9-dihydrodiol
Property Insights of 7-Hydroxymethylbenz(a)anthracene-8,9-dihydrodiol
The XLogP value of 2.9064 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Hydroxymethylbenz(a)anthracene-8,9-dihydrodiol. The TPSA of 60.69 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-Hydroxymethylbenz(a)anthracene-8,9-dihydrodiol. Following Lipinski's Rule of Five, 7-Hydroxymethylbenz(a)anthracene-8,9-dihydrodiol has 3 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 7-Hydroxymethylbenz(a)anthracene-8,9-dihydrodiol?
The CAS number of 7-Hydroxymethylbenz(a)anthracene-8,9-dihydrodiol is 16053-72-8.
What is the molecular formula of 7-Hydroxymethylbenz(a)anthracene-8,9-dihydrodiol?
The molecular formula of 7-Hydroxymethylbenz(a)anthracene-8,9-dihydrodiol is C19H16O3.
What is the molecular weight of 7-Hydroxymethylbenz(a)anthracene-8,9-dihydrodiol?
The molecular weight of 7-Hydroxymethylbenz(a)anthracene-8,9-dihydrodiol is 292.11 g/mol.
Where can I buy 7-Hydroxymethylbenz(a)anthracene-8,9-dihydrodiol?
You can request a quote for 7-Hydroxymethylbenz(a)anthracene-8,9-dihydrodiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Hydroxymethylbenz(a)anthracene-8,9-dihydrodiol?
Yes, KEHONG BIO provides custom synthesis services for 7-Hydroxymethylbenz(a)anthracene-8,9-dihydrodiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.