12-Hydroxymethyl-7-methylbenz(a)anthracene-8,9-dihydrodiol, trans-
TL;DR: 12-Hydroxymethyl-7-methylbenz(a)anthracene-8,9-dihydrodiol, trans- (CAS 70206-45-0) is a chemical compound with molecular formula C20H18O3 and molecular weight 306.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8S,9S)-12-(hydroxymethyl)-7-methyl-8,9-dihydrobenzo[a]anthracene-8,9-diol
Also Known As: Ivermectin B1b, trans-12-Hydroxymethyl-7-methylbenz(a)anthracene-8,9-dihydrodiol, BENZ(a)ANTHRACENE-8,9-DIOL, 8,9-DIHYDRO-12-(HYDROXYMETHYL)-7-METHYL-, trans-, trans-8,9-Dihydro-12-(hydroxymethyl)-7-methylbenz(a)anthracene-8,9-diol, 12-Hydroxymethyl-7-methylbenz(a)anthracene-8,9-dihydrodiol, trans-
| Molecular Formula | C20H18O3 |
|---|---|
| Molecular Weight | 306.13 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 60.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 306.12558 |
| Heavy Atoms | 23 |
| Complexity | 462.0 |
Chemical Identifiers
| CAS Number | 70206-45-0 |
|---|---|
| SMILES | CC1=C2C=CC3=CC=CC=C3C2=C(C4=C1[C@@H]([C@H](C=C4)O)O)CO |
| InChIKey | JKOCLQQMJRIWJU-FXAWDEMLSA-N |
Product Overview
12-Hydroxymethyl-7-methylbenz(a)anthracene-8,9-dihydrodiol, trans- (CAS 70206-45-0), with molecular formula C20H18O3 and molecular weight 306.13 g/mol. IUPAC: (8S,9S)-12-(hydroxymethyl)-7-methyl-8,9-dihydrobenzo[a]anthracene-8,9-diol.
Chemical Property Profile of 12-Hydroxymethyl-7-methylbenz(a)anthracene-8,9-dihydrodiol, trans-
Property Insights of 12-Hydroxymethyl-7-methylbenz(a)anthracene-8,9-dihydrodiol, trans-
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 12-Hydroxymethyl-7-methylbenz(a)anthracene-8,9-dihydrodiol, trans-. The TPSA of 60.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 12-Hydroxymethyl-7-methylbenz(a)anthracene-8,9-dihydrodiol, trans-. Following Lipinski's Rule of Five, 12-Hydroxymethyl-7-methylbenz(a)anthracene-8,9-dihydrodiol, trans- 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 12-Hydroxymethyl-7-methylbenz(a)anthracene-8,9-dihydrodiol, trans-?
The CAS number of 12-Hydroxymethyl-7-methylbenz(a)anthracene-8,9-dihydrodiol, trans- is 70206-45-0.
What is the molecular formula of 12-Hydroxymethyl-7-methylbenz(a)anthracene-8,9-dihydrodiol, trans-?
The molecular formula of 12-Hydroxymethyl-7-methylbenz(a)anthracene-8,9-dihydrodiol, trans- is C20H18O3.
What is the molecular weight of 12-Hydroxymethyl-7-methylbenz(a)anthracene-8,9-dihydrodiol, trans-?
The molecular weight of 12-Hydroxymethyl-7-methylbenz(a)anthracene-8,9-dihydrodiol, trans- is 306.13 g/mol.
Where can I buy 12-Hydroxymethyl-7-methylbenz(a)anthracene-8,9-dihydrodiol, trans-?
You can request a quote for 12-Hydroxymethyl-7-methylbenz(a)anthracene-8,9-dihydrodiol, trans- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 12-Hydroxymethyl-7-methylbenz(a)anthracene-8,9-dihydrodiol, trans-?
Yes, KEHONG BIO provides custom synthesis services for 12-Hydroxymethyl-7-methylbenz(a)anthracene-8,9-dihydrodiol, trans- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.