Tropane, 3-(alpha-(alpha,alpha,alpha-trifluoro-p-tolyl)benzyloxy)-, fumarate
TL;DR: Tropane, 3-(alpha-(alpha,alpha,alpha-trifluoro-p-tolyl)benzyloxy)-, fumarate (CAS 3560-78-9) is a chemical compound with molecular formula C26H28F3NO5 and molecular weight 491.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-but-2-enedioic acid;8-methyl-3-[phenyl-[4-(trifluoromethyl)phenyl]methoxy]-8-azabicyclo[3.2.1]octane
Also Known As: 3-(alpha-(alpha,alpha,alpha-Trifluoro-p-tolyl)benzyloxy)tropane fumarate, Tropane, 3-(alpha-(alpha,alpha,alpha-trifluoro-p-tolyl)benzyloxy)-, fumarate, (E)-but-2-enedioic acid; 8-methyl-3-[phenyl-[4-(trifluoromethyl)phenyl]methoxy]-8-azabicyclo[3.2.1]octane, RefChem:1100562
| Molecular Formula | C26H28F3NO5 |
|---|---|
| Molecular Weight | 491.19 g/mol |
| LogP | 5.1484 |
| Topological Polar Surface Area | 87.07 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 491.19196 |
| Heavy Atoms | 35 |
| Complexity | 993.53284 |
Chemical Identifiers
| CAS Number | 3560-78-9 |
|---|---|
| SMILES | CN1C2CCC1CC(C2)OC(C3=CC=CC=C3)C4=CC=C(C=C4)C(F)(F)F.C(=C/C(=O)O)\C(=O)O |
Product Overview
Tropane, 3-(alpha-(alpha,alpha,alpha-trifluoro-p-tolyl)benzyloxy)-, fumarate (CAS 3560-78-9), with molecular formula C26H28F3NO5 and molecular weight 491.19 g/mol. IUPAC: (E)-but-2-enedioic acid;8-methyl-3-[phenyl-[4-(trifluoromethyl)phenyl]methoxy]-8-azabicyclo[3.2.1]octane.
Chemical Property Profile of Tropane, 3-(alpha-(alpha,alpha,alpha-trifluoro-p-tolyl)benzyloxy)-, fumarate
Property Insights of Tropane, 3-(alpha-(alpha,alpha,alpha-trifluoro-p-tolyl)benzyloxy)-, fumarate
The XLogP value of 5.1484 indicates that Tropane, 3-(alpha-(alpha,alpha,alpha-trifluoro-p-tolyl)benzyloxy)-, fumarate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.07 Ų falls within the moderate polarity range, balancing permeability and solubility for Tropane, 3-(alpha-(alpha,alpha,alpha-trifluoro-p-tolyl)benzyloxy)-, fumarate. Following Lipinski's Rule of Five, Tropane, 3-(alpha-(alpha,alpha,alpha-trifluoro-p-tolyl)benzyloxy)-, fumarate has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Tropane, 3-(alpha-(alpha,alpha,alpha-trifluoro-p-tolyl)benzyloxy)-, fumarate?
The CAS number of Tropane, 3-(alpha-(alpha,alpha,alpha-trifluoro-p-tolyl)benzyloxy)-, fumarate is 3560-78-9.
What is the molecular formula of Tropane, 3-(alpha-(alpha,alpha,alpha-trifluoro-p-tolyl)benzyloxy)-, fumarate?
The molecular formula of Tropane, 3-(alpha-(alpha,alpha,alpha-trifluoro-p-tolyl)benzyloxy)-, fumarate is C26H28F3NO5.
What is the molecular weight of Tropane, 3-(alpha-(alpha,alpha,alpha-trifluoro-p-tolyl)benzyloxy)-, fumarate?
The molecular weight of Tropane, 3-(alpha-(alpha,alpha,alpha-trifluoro-p-tolyl)benzyloxy)-, fumarate is 491.19 g/mol.
Where can I buy Tropane, 3-(alpha-(alpha,alpha,alpha-trifluoro-p-tolyl)benzyloxy)-, fumarate?
You can request a quote for Tropane, 3-(alpha-(alpha,alpha,alpha-trifluoro-p-tolyl)benzyloxy)-, fumarate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tropane, 3-(alpha-(alpha,alpha,alpha-trifluoro-p-tolyl)benzyloxy)-, fumarate?
Yes, KEHONG BIO provides custom synthesis services for Tropane, 3-(alpha-(alpha,alpha,alpha-trifluoro-p-tolyl)benzyloxy)-, fumarate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.