2,2,2-Trifluoroethyl chloroformate
TL;DR: 2,2,2-Trifluoroethyl chloroformate (CAS 27746-99-2) is a chemical compound with molecular formula C3H2ClF3O2 and molecular weight 161.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,2-trifluoroethyl carbonochloridate
Also Known As: 2,2,2-trifluoroethyl carbonochloridate, 2,2,2-TRIFLUOROETHYL CHLOROFORMATE, trifluoroethyl chloroformate, 2,2,2-trifluoroethyl chloridocarbonate, Carbonochloridic acid, 2,2,2-trifluoroethyl ester
| Molecular Formula | C3H2ClF3O2 |
|---|---|
| Molecular Weight | 161.97 g/mol |
| LogP | 1.9241 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 161.96954 |
| Heavy Atoms | 9 |
| Complexity | 110.115715 |
Chemical Identifiers
| CAS Number | 27746-99-2 |
|---|---|
| SMILES | C(C(F)(F)F)OC(=O)Cl |
Product Overview
2,2,2-Trifluoroethyl chloroformate (CAS 27746-99-2), with molecular formula C3H2ClF3O2 and molecular weight 161.97 g/mol. IUPAC: 2,2,2-trifluoroethyl carbonochloridate.
Chemical Property Profile of 2,2,2-Trifluoroethyl chloroformate
Property Insights of 2,2,2-Trifluoroethyl chloroformate
The XLogP value of 1.9241 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2,2-Trifluoroethyl chloroformate. With a topological polar surface area (TPSA) of 26.3 Ų, 2,2,2-Trifluoroethyl chloroformate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2,2-Trifluoroethyl chloroformate has 0 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 2,2,2-Trifluoroethyl chloroformate?
The CAS number of 2,2,2-Trifluoroethyl chloroformate is 27746-99-2.
What is the molecular formula of 2,2,2-Trifluoroethyl chloroformate?
The molecular formula of 2,2,2-Trifluoroethyl chloroformate is C3H2ClF3O2.
What is the molecular weight of 2,2,2-Trifluoroethyl chloroformate?
The molecular weight of 2,2,2-Trifluoroethyl chloroformate is 161.97 g/mol.
Where can I buy 2,2,2-Trifluoroethyl chloroformate?
You can request a quote for 2,2,2-Trifluoroethyl chloroformate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2,2-Trifluoroethyl chloroformate?
Yes, KEHONG BIO provides custom synthesis services for 2,2,2-Trifluoroethyl chloroformate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.