(1S,2S)-1,2,3,4-Tetrahydrobenzo(a)anthracene-1,2-diol
TL;DR: (1S,2S)-1,2,3,4-Tetrahydrobenzo(a)anthracene-1,2-diol (CAS 94903-85-2) is a chemical compound with molecular formula C18H16O2 and molecular weight 264.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,2S)-1,2,3,4-tetrahydrobenzo[a]anthracene-1,2-diol
Also Known As: (1S,2S)-1,2,3,4-Tetrahydrobenzo(a)anthracene-1,2-diol, (1S,2S)-1,2,3,4-tetrahydrobenzo[a]anthracene-1,2-diol, Benzo(a)anthracen-1,2-diol, 1,2,3,4-tetrahydro-, (1R,2R)-rel-
| Molecular Formula | C18H16O2 |
|---|---|
| Molecular Weight | 264.12 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 264.11502 |
| Heavy Atoms | 20 |
| Complexity | 355.0 |
Chemical Identifiers
| CAS Number | 94903-85-2 |
|---|---|
| SMILES | C1CC2=C([C@@H]([C@H]1O)O)C3=CC4=CC=CC=C4C=C3C=C2 |
| InChIKey | WOQGBPMDKYIJRI-FUHWJXTLSA-N |
Product Overview
(1S,2S)-1,2,3,4-Tetrahydrobenzo(a)anthracene-1,2-diol (CAS 94903-85-2), with molecular formula C18H16O2 and molecular weight 264.12 g/mol. IUPAC: (1S,2S)-1,2,3,4-tetrahydrobenzo[a]anthracene-1,2-diol.
Chemical Property Profile of (1S,2S)-1,2,3,4-Tetrahydrobenzo(a)anthracene-1,2-diol
Property Insights of (1S,2S)-1,2,3,4-Tetrahydrobenzo(a)anthracene-1,2-diol
The XLogP value of 3.1 indicates that (1S,2S)-1,2,3,4-Tetrahydrobenzo(a)anthracene-1,2-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, (1S,2S)-1,2,3,4-Tetrahydrobenzo(a)anthracene-1,2-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1S,2S)-1,2,3,4-Tetrahydrobenzo(a)anthracene-1,2-diol 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
Frequently Asked Questions
What is the CAS number of (1S,2S)-1,2,3,4-Tetrahydrobenzo(a)anthracene-1,2-diol?
The CAS number of (1S,2S)-1,2,3,4-Tetrahydrobenzo(a)anthracene-1,2-diol is 94903-85-2.
What is the molecular formula of (1S,2S)-1,2,3,4-Tetrahydrobenzo(a)anthracene-1,2-diol?
The molecular formula of (1S,2S)-1,2,3,4-Tetrahydrobenzo(a)anthracene-1,2-diol is C18H16O2.
What is the molecular weight of (1S,2S)-1,2,3,4-Tetrahydrobenzo(a)anthracene-1,2-diol?
The molecular weight of (1S,2S)-1,2,3,4-Tetrahydrobenzo(a)anthracene-1,2-diol is 264.12 g/mol.
Where can I buy (1S,2S)-1,2,3,4-Tetrahydrobenzo(a)anthracene-1,2-diol?
You can request a quote for (1S,2S)-1,2,3,4-Tetrahydrobenzo(a)anthracene-1,2-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1S,2S)-1,2,3,4-Tetrahydrobenzo(a)anthracene-1,2-diol?
Yes, KEHONG BIO provides custom synthesis services for (1S,2S)-1,2,3,4-Tetrahydrobenzo(a)anthracene-1,2-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.