(+)-(3S,4S)-trans-3,4-Dihydro-3,4-dihydroxybenz(a)anthracene
TL;DR: (+)-(3S,4S)-trans-3,4-Dihydro-3,4-dihydroxybenz(a)anthracene (CAS 67335-43-7) is a chemical compound with molecular formula C18H14O2 and molecular weight 262.09937 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3S,4S)-3,4-dihydrobenzo[a]anthracene-3,4-diol
Also Known As: BA 3,4-Dihydrodiol, Benz(a)anthracene-3,4-dihydrodiol, BENZ ANTHRACENE-3,4-DIHYDRODIOL, (3S,4S)-3,4-dihydrobenzo[a]anthracene-3,4-diol, (3S,4S)-3,4-dihydrotetraphene-3,4-diol
Technical Specifications
| Molecular Formula | C18H14O2 |
| Molecular Weight | 262.09937 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 262.09937 Da |
| Heavy Atoms | 20 |
| Complexity | 391.0 |
| SMILES | C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C=C[C@@H]([C@H]4O)O |
| InChIKey | KUBYVPFVNKJERF-ROUUACIJSA-N |
Chemical Property Profile of (+)-(3S,4S)-trans-3,4-Dihydro-3,4-dihydroxybenz(a)anthracene
Property Insights of (+)-(3S,4S)-trans-3,4-Dihydro-3,4-dihydroxybenz(a)anthracene
The XLogP value of 3.0 indicates that (+)-(3S,4S)-trans-3,4-Dihydro-3,4-dihydroxybenz(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, (+)-(3S,4S)-trans-3,4-Dihydro-3,4-dihydroxybenz(a)anthracene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (+)-(3S,4S)-trans-3,4-Dihydro-3,4-dihydroxybenz(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 (+)-(3S,4S)-trans-3,4-Dihydro-3,4-dihydroxybenz(a)anthracene?
The CAS number of (+)-(3S,4S)-trans-3,4-Dihydro-3,4-dihydroxybenz(a)anthracene is 67335-43-7.
What is the molecular formula of (+)-(3S,4S)-trans-3,4-Dihydro-3,4-dihydroxybenz(a)anthracene?
The molecular formula of (+)-(3S,4S)-trans-3,4-Dihydro-3,4-dihydroxybenz(a)anthracene is C18H14O2.
What is the molecular weight of (+)-(3S,4S)-trans-3,4-Dihydro-3,4-dihydroxybenz(a)anthracene?
The molecular weight of (+)-(3S,4S)-trans-3,4-Dihydro-3,4-dihydroxybenz(a)anthracene is 262.09937 g/mol.
Where can I buy (+)-(3S,4S)-trans-3,4-Dihydro-3,4-dihydroxybenz(a)anthracene?
You can request a quote for (+)-(3S,4S)-trans-3,4-Dihydro-3,4-dihydroxybenz(a)anthracene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (+)-(3S,4S)-trans-3,4-Dihydro-3,4-dihydroxybenz(a)anthracene?
Yes, CoreyChem provides custom synthesis services for (+)-(3S,4S)-trans-3,4-Dihydro-3,4-dihydroxybenz(a)anthracene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.