2,2,2-trifluoroethyl N-methylcarbamate
TL;DR: 2,2,2-trifluoroethyl N-methylcarbamate (CAS 878218-01-0) is a chemical compound with molecular formula C4H6F3NO2 and molecular weight 157.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,2-trifluoroethyl N-methylcarbamate
Also Known As: 2,2,2-trifluoroethyl N-methylcarbamate, 2,2,2-trifluoroethyl methylcarbamate, 2,2,2-trifluoroethylN-methylcarbamate, 102-648-0, RefChem:440550
| Molecular Formula | C4H6F3NO2 |
|---|---|
| Molecular Weight | 157.04 g/mol |
| LogP | 0.9047 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 157.03506 |
| Heavy Atoms | 10 |
| Complexity | 122.16134 |
Chemical Identifiers
| CAS Number | 878218-01-0 |
|---|---|
| SMILES | CNC(=O)OCC(F)(F)F |
Product Overview
2,2,2-trifluoroethyl N-methylcarbamate (CAS 878218-01-0), with molecular formula C4H6F3NO2 and molecular weight 157.04 g/mol. IUPAC: 2,2,2-trifluoroethyl N-methylcarbamate.
Chemical Property Profile of 2,2,2-trifluoroethyl N-methylcarbamate
Property Insights of 2,2,2-trifluoroethyl N-methylcarbamate
The XLogP value of 0.9047 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2,2-trifluoroethyl N-methylcarbamate. With a topological polar surface area (TPSA) of 38.33 Ų, 2,2,2-trifluoroethyl N-methylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2,2-trifluoroethyl N-methylcarbamate has 1 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 N-methylcarbamate?
The CAS number of 2,2,2-trifluoroethyl N-methylcarbamate is 878218-01-0.
What is the molecular formula of 2,2,2-trifluoroethyl N-methylcarbamate?
The molecular formula of 2,2,2-trifluoroethyl N-methylcarbamate is C4H6F3NO2.
What is the molecular weight of 2,2,2-trifluoroethyl N-methylcarbamate?
The molecular weight of 2,2,2-trifluoroethyl N-methylcarbamate is 157.04 g/mol.
Where can I buy 2,2,2-trifluoroethyl N-methylcarbamate?
You can request a quote for 2,2,2-trifluoroethyl N-methylcarbamate 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 N-methylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for 2,2,2-trifluoroethyl N-methylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.