7,12-Dihydro-7,12-dimethyl-7,12-epoxybenz(a)anthracene
TL;DR: 7,12-Dihydro-7,12-dimethyl-7,12-epoxybenz(a)anthracene (CAS 63019-25-0) is a chemical compound with molecular formula C20H16O and molecular weight 272.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,12-dimethyl-19-oxapentacyclo[10.6.1.02,11.03,8.013,18]nonadeca-2(11),3,5,7,9,13,15,17-octaene
Also Known As: 9:10-Dimethyl-1:2-benzanthracene-9:10-oxide, 7,12-Dihydro-7,12-dimethyl-7,12-epoxybenz(a)anthracene, 4-17-00-00738 (Beilstein Handbook Reference), 7,12-Dihydro-7,12-dimethyl-7,12-epoxybenz[a]anthracene, 7,12-Dimethyl-7,12-dihydro-7,12-epoxytetraphene
| Molecular Formula | C20H16O |
|---|---|
| Molecular Weight | 272.12 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 272.12012 |
| Heavy Atoms | 21 |
| Complexity | 445.0 |
Chemical Identifiers
| CAS Number | 63019-25-0 |
|---|---|
| SMILES | CC12C3=C(C4=CC=CC=C4C=C3)C(O1)(C5=CC=CC=C25)C |
| InChIKey | VODWUUURUIFALR-UHFFFAOYSA-N |
Product Overview
7,12-Dihydro-7,12-dimethyl-7,12-epoxybenz(a)anthracene (CAS 63019-25-0), with molecular formula C20H16O and molecular weight 272.12 g/mol. IUPAC: 1,12-dimethyl-19-oxapentacyclo[10.6.1.02,11.03,8.013,18]nonadeca-2(11),3,5,7,9,13,15,17-octaene.
Chemical Property Profile of 7,12-Dihydro-7,12-dimethyl-7,12-epoxybenz(a)anthracene
Property Insights of 7,12-Dihydro-7,12-dimethyl-7,12-epoxybenz(a)anthracene
The XLogP value of 4.2 indicates that 7,12-Dihydro-7,12-dimethyl-7,12-epoxybenz(a)anthracene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, 7,12-Dihydro-7,12-dimethyl-7,12-epoxybenz(a)anthracene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7,12-Dihydro-7,12-dimethyl-7,12-epoxybenz(a)anthracene has 0 hydrogen bond donor(s) and 1 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 7,12-Dihydro-7,12-dimethyl-7,12-epoxybenz(a)anthracene?
The CAS number of 7,12-Dihydro-7,12-dimethyl-7,12-epoxybenz(a)anthracene is 63019-25-0.
What is the molecular formula of 7,12-Dihydro-7,12-dimethyl-7,12-epoxybenz(a)anthracene?
The molecular formula of 7,12-Dihydro-7,12-dimethyl-7,12-epoxybenz(a)anthracene is C20H16O.
What is the molecular weight of 7,12-Dihydro-7,12-dimethyl-7,12-epoxybenz(a)anthracene?
The molecular weight of 7,12-Dihydro-7,12-dimethyl-7,12-epoxybenz(a)anthracene is 272.12 g/mol.
Where can I buy 7,12-Dihydro-7,12-dimethyl-7,12-epoxybenz(a)anthracene?
You can request a quote for 7,12-Dihydro-7,12-dimethyl-7,12-epoxybenz(a)anthracene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7,12-Dihydro-7,12-dimethyl-7,12-epoxybenz(a)anthracene?
Yes, KEHONG BIO provides custom synthesis services for 7,12-Dihydro-7,12-dimethyl-7,12-epoxybenz(a)anthracene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.