9,10-Diethylbenz(a)anthracene-3,4-diol
TL;DR: 9,10-Diethylbenz(a)anthracene-3,4-diol (CAS 64414-71-7) is a chemical compound with molecular formula C22H20O2 and molecular weight 316.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9,10-diethylbenzo[a]anthracene-3,4-diol
Also Known As: 9,10-Diethylbenz(a)anthracene-3,4-diol, Benzidine,3,3'-dichloro-,sulfate, Benz(a)anthracene-3,4-diol, 9,10-diethyl-, 9,10-diethylbenzo[a]anthracene-3,4-diol, 9,10-DIETHYLTETRAPHENE-3,4-DIOL
| Molecular Formula | C22H20O2 |
|---|---|
| Molecular Weight | 316.15 g/mol |
| LogP | 6.6 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 316.14633 |
| Heavy Atoms | 24 |
| Complexity | 436.0 |
Chemical Identifiers
| CAS Number | 64414-71-7 |
|---|---|
| SMILES | CCC1=C(C=C2C=C3C(=CC2=C1)C=CC4=C3C=CC(=C4O)O)CC |
| InChIKey | MHLODBQYXDECLV-UHFFFAOYSA-N |
Product Overview
9,10-Diethylbenz(a)anthracene-3,4-diol (CAS 64414-71-7), with molecular formula C22H20O2 and molecular weight 316.15 g/mol. IUPAC: 9,10-diethylbenzo[a]anthracene-3,4-diol.
Chemical Property Profile of 9,10-Diethylbenz(a)anthracene-3,4-diol
Property Insights of 9,10-Diethylbenz(a)anthracene-3,4-diol
The XLogP value of 6.6 indicates that 9,10-Diethylbenz(a)anthracene-3,4-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, 9,10-Diethylbenz(a)anthracene-3,4-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9,10-Diethylbenz(a)anthracene-3,4-diol has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 9,10-Diethylbenz(a)anthracene-3,4-diol?
The CAS number of 9,10-Diethylbenz(a)anthracene-3,4-diol is 64414-71-7.
What is the molecular formula of 9,10-Diethylbenz(a)anthracene-3,4-diol?
The molecular formula of 9,10-Diethylbenz(a)anthracene-3,4-diol is C22H20O2.
What is the molecular weight of 9,10-Diethylbenz(a)anthracene-3,4-diol?
The molecular weight of 9,10-Diethylbenz(a)anthracene-3,4-diol is 316.15 g/mol.
Where can I buy 9,10-Diethylbenz(a)anthracene-3,4-diol?
You can request a quote for 9,10-Diethylbenz(a)anthracene-3,4-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9,10-Diethylbenz(a)anthracene-3,4-diol?
Yes, KEHONG BIO provides custom synthesis services for 9,10-Diethylbenz(a)anthracene-3,4-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.