Tropoxane
TL;DR: Tropoxane (CAS 192461-10-2) is a chemical compound with molecular formula C15H16Cl2O3 and molecular weight 314.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (1R,2S,3S,5S)-3-(3,4-dichlorophenyl)-8-oxabicyclo[3.2.1]octane-2-carboxylate
Also Known As: Tropoxane, Tropoxane (O-1072), Methyl (1R,2S,3S,5S)-3-(3,4-dichlorophenyl)-8-oxabicyclo[3.2.1]octane-2-carboxylate, Methyl (2S,3S)-3-(3,4-dichlorophenyl)-8-oxabicyclo[3.2.1]octane-2-carboxylate, (1R,2S,5S)-3beta-(3,4-Dichlorophenyl)-8-oxabicyclo[3.2.1]octane-2beta-carboxylic acid methyl ester
| Molecular Formula | C15H16Cl2O3 |
|---|---|
| Molecular Weight | 314.05 g/mol |
| LogP | 3.8175 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 314.04764 |
| Heavy Atoms | 20 |
| Complexity | 531.85 |
Chemical Identifiers
| CAS Number | 192461-10-2 |
|---|---|
| SMILES | COC(=O)[C@@H]1[C@H]2CC[C@H](O2)C[C@@H]1C3=CC(=C(C=C3)Cl)Cl |
Product Overview
Tropoxane (CAS 192461-10-2), with molecular formula C15H16Cl2O3 and molecular weight 314.05 g/mol. IUPAC: methyl (1R,2S,3S,5S)-3-(3,4-dichlorophenyl)-8-oxabicyclo[3.2.1]octane-2-carboxylate.
Chemical Property Profile of Tropoxane
Property Insights of Tropoxane
The XLogP value of 3.8175 indicates that Tropoxane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, Tropoxane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tropoxane has 0 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 Tropoxane?
The CAS number of Tropoxane is 192461-10-2.
What is the molecular formula of Tropoxane?
The molecular formula of Tropoxane is C15H16Cl2O3.
What is the molecular weight of Tropoxane?
The molecular weight of Tropoxane is 314.05 g/mol.
Where can I buy Tropoxane?
You can request a quote for Tropoxane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tropoxane?
Yes, KEHONG BIO provides custom synthesis services for Tropoxane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.