CI 966 hydrochloride
TL;DR: CI 966 hydrochloride (CAS 110283-66-4) is a chemical compound with molecular formula C23H22ClF6NO3 and molecular weight 509.11923 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[2-[bis[4-(trifluoromethyl)phenyl]methoxy]ethyl]-3,6-dihydro-2H-pyridine-5-carboxylic acid;hydrochloride
Also Known As: CI 966 hydrochloride, CI-966 hydrochloride, Color Index No. 966, Color Index Number 966, Colour Index No. 966
Technical Specifications
| Molecular Formula | C23H22ClF6NO3 |
| Molecular Weight | 509.11923 g/mol |
| XLogP | 5.9687 |
| Topological Polar Surface Area (TPSA) | 49.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 509.11923 Da |
| Heavy Atoms | 34 |
| Complexity | 643.0 |
| SMILES | C1CN(CC(=C1)C(=O)O)CCOC(C2=CC=C(C=C2)C(F)(F)F)C3=CC=C(C=C3)C(F)(F)F.Cl |
| InChIKey | NUQWSOWKRTZJTO-UHFFFAOYSA-N |
Chemical Property Profile of CI 966 hydrochloride
Property Insights of CI 966 hydrochloride
The XLogP value of 5.9687 indicates that CI 966 hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.8 Ų, CI 966 hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CI 966 hydrochloride has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of CI 966 hydrochloride?
The CAS number of CI 966 hydrochloride is 110283-66-4.
What is the molecular formula of CI 966 hydrochloride?
The molecular formula of CI 966 hydrochloride is C23H22ClF6NO3.
What is the molecular weight of CI 966 hydrochloride?
The molecular weight of CI 966 hydrochloride is 509.11923 g/mol.
Where can I buy CI 966 hydrochloride?
You can request a quote for CI 966 hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for CI 966 hydrochloride?
Yes, CoreyChem provides custom synthesis services for CI 966 hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.