3,4-Dihydroxy-3,4-dihydro-7-ethylbenz(a)anthracene
TL;DR: 3,4-Dihydroxy-3,4-dihydro-7-ethylbenz(a)anthracene (CAS 111876-20-1) is a chemical compound with molecular formula C20H18O2 and molecular weight 290.13068 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3S,4S)-7-ethyl-3,4-dihydrobenzo[a]anthracene-3,4-diol
Also Known As: EBAD, 3,4-Dihydroxy-3,4-dihydro-7-ethylbenz(a)anthracene, 7-ethyl-3,4-dihydrotetraphene-3,4-diol, 7-Ethyl-3,4-dihydrobenz(a)anthracene-3,4-diol, (3S,4S)-7-ethyl-3,4-dihydrobenzo[a]anthracene-3,4-diol
Technical Specifications
| Molecular Formula | C20H18O2 |
| Molecular Weight | 290.13068 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 290.13068 Da |
| Heavy Atoms | 22 |
| Complexity | 431.0 |
| SMILES | CCC1=C2C=CC3=C(C2=CC4=CC=CC=C41)C=C[C@@H]([C@H]3O)O |
| InChIKey | RWPZESDFTQDOHT-PMACEKPBSA-N |
Chemical Property Profile of 3,4-Dihydroxy-3,4-dihydro-7-ethylbenz(a)anthracene
Property Insights of 3,4-Dihydroxy-3,4-dihydro-7-ethylbenz(a)anthracene
The XLogP value of 3.8 indicates that 3,4-Dihydroxy-3,4-dihydro-7-ethylbenz(a)anthracene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, 3,4-Dihydroxy-3,4-dihydro-7-ethylbenz(a)anthracene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-Dihydroxy-3,4-dihydro-7-ethylbenz(a)anthracene 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
What is the CAS number of 3,4-Dihydroxy-3,4-dihydro-7-ethylbenz(a)anthracene?
The CAS number of 3,4-Dihydroxy-3,4-dihydro-7-ethylbenz(a)anthracene is 111876-20-1.
What is the molecular formula of 3,4-Dihydroxy-3,4-dihydro-7-ethylbenz(a)anthracene?
The molecular formula of 3,4-Dihydroxy-3,4-dihydro-7-ethylbenz(a)anthracene is C20H18O2.
What is the molecular weight of 3,4-Dihydroxy-3,4-dihydro-7-ethylbenz(a)anthracene?
The molecular weight of 3,4-Dihydroxy-3,4-dihydro-7-ethylbenz(a)anthracene is 290.13068 g/mol.
Where can I buy 3,4-Dihydroxy-3,4-dihydro-7-ethylbenz(a)anthracene?
You can request a quote for 3,4-Dihydroxy-3,4-dihydro-7-ethylbenz(a)anthracene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3,4-Dihydroxy-3,4-dihydro-7-ethylbenz(a)anthracene?
Yes, CoreyChem provides custom synthesis services for 3,4-Dihydroxy-3,4-dihydro-7-ethylbenz(a)anthracene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.