Allyl 2-chloro-1,1,2-trifluoroethyl ether
TL;DR: Allyl 2-chloro-1,1,2-trifluoroethyl ether (CAS 380-44-9) is a chemical compound with molecular formula C5H6ClF3O and molecular weight 174.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-chloro-1,1,2-trifluoroethoxy)prop-1-ene
Also Known As: Allyl 2-chloro-1,1,2-trifluoroethyl ether, 2-Bromo-2-methylpropane, 3-(2-chloro-1,1,2-trifluoroethoxy)prop-1-ene, 2-chloro-1,1,2-trifluoroethyl allyl ether, 3-(2-Chloro-1,1,2-trifluoroethoxy)-1-propene
| Molecular Formula | C5H6ClF3O |
|---|---|
| Molecular Weight | 174.01 g/mol |
| LogP | 2.3162 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 174.00592 |
| Heavy Atoms | 10 |
| Complexity | 115.46069 |
Chemical Identifiers
| CAS Number | 380-44-9 |
|---|---|
| SMILES | C=CCOC(C(F)Cl)(F)F |
Product Overview
Allyl 2-chloro-1,1,2-trifluoroethyl ether (CAS 380-44-9), with molecular formula C5H6ClF3O and molecular weight 174.01 g/mol. IUPAC: 3-(2-chloro-1,1,2-trifluoroethoxy)prop-1-ene.
Chemical Property Profile of Allyl 2-chloro-1,1,2-trifluoroethyl ether
Property Insights of Allyl 2-chloro-1,1,2-trifluoroethyl ether
The XLogP value of 2.3162 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Allyl 2-chloro-1,1,2-trifluoroethyl ether. With a topological polar surface area (TPSA) of 9.23 Ų, Allyl 2-chloro-1,1,2-trifluoroethyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Allyl 2-chloro-1,1,2-trifluoroethyl ether has 0 hydrogen bond donor(s) and 1 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 Allyl 2-chloro-1,1,2-trifluoroethyl ether?
The CAS number of Allyl 2-chloro-1,1,2-trifluoroethyl ether is 380-44-9.
What is the molecular formula of Allyl 2-chloro-1,1,2-trifluoroethyl ether?
The molecular formula of Allyl 2-chloro-1,1,2-trifluoroethyl ether is C5H6ClF3O.
What is the molecular weight of Allyl 2-chloro-1,1,2-trifluoroethyl ether?
The molecular weight of Allyl 2-chloro-1,1,2-trifluoroethyl ether is 174.01 g/mol.
Where can I buy Allyl 2-chloro-1,1,2-trifluoroethyl ether?
You can request a quote for Allyl 2-chloro-1,1,2-trifluoroethyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Allyl 2-chloro-1,1,2-trifluoroethyl ether?
Yes, KEHONG BIO provides custom synthesis services for Allyl 2-chloro-1,1,2-trifluoroethyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.