2,2,2-trifluoroethyl N-benzylcarbamate
TL;DR: 2,2,2-trifluoroethyl N-benzylcarbamate (CAS 201487-97-0) is a chemical compound with molecular formula C10H10F3NO2 and molecular weight 233.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,2-trifluoroethyl N-benzylcarbamate
Also Known As: 2,2,2-trifluoroethyl benzylcarbamate, 2,2,2-trifluoroethyl N-benzylcarbamate, 2,2,2-trifluoroethylbenzylcarbamate, J1.286.380B, N-Benzylcarbamic acid 2,2,2-trifluoroethyl ester
| Molecular Formula | C10H10F3NO2 |
|---|---|
| Molecular Weight | 233.07 g/mol |
| LogP | 2.4751 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 233.06636 |
| Heavy Atoms | 16 |
| Complexity | 337.66742 |
Chemical Identifiers
| CAS Number | 201487-97-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNC(=O)OCC(F)(F)F |
Product Overview
2,2,2-trifluoroethyl N-benzylcarbamate (CAS 201487-97-0), with molecular formula C10H10F3NO2 and molecular weight 233.07 g/mol. IUPAC: 2,2,2-trifluoroethyl N-benzylcarbamate.
Chemical Property Profile of 2,2,2-trifluoroethyl N-benzylcarbamate
Property Insights of 2,2,2-trifluoroethyl N-benzylcarbamate
The XLogP value of 2.4751 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2,2-trifluoroethyl N-benzylcarbamate. With a topological polar surface area (TPSA) of 38.33 Ų, 2,2,2-trifluoroethyl N-benzylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2,2-trifluoroethyl N-benzylcarbamate 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-benzylcarbamate?
The CAS number of 2,2,2-trifluoroethyl N-benzylcarbamate is 201487-97-0.
What is the molecular formula of 2,2,2-trifluoroethyl N-benzylcarbamate?
The molecular formula of 2,2,2-trifluoroethyl N-benzylcarbamate is C10H10F3NO2.
What is the molecular weight of 2,2,2-trifluoroethyl N-benzylcarbamate?
The molecular weight of 2,2,2-trifluoroethyl N-benzylcarbamate is 233.07 g/mol.
Where can I buy 2,2,2-trifluoroethyl N-benzylcarbamate?
You can request a quote for 2,2,2-trifluoroethyl N-benzylcarbamate 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-benzylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for 2,2,2-trifluoroethyl N-benzylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.