Phenyl-carbamic acid 2,2,2-trifluoro-1-phenyl-ethyl ester
TL;DR: Phenyl-carbamic acid 2,2,2-trifluoro-1-phenyl-ethyl ester (CAS 2648-11-5) is a chemical compound with molecular formula C15H12F3NO2 and molecular weight 295.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,2,2-trifluoro-1-phenylethyl) N-phenylcarbamate
Also Known As: 2,2,2-trifluoro-1-phenylethyl N-phenylcarbamate, 2,2,2-trifluoro-1-phenylethyl phenylcarbamate, (2,2,2-trifluoro-1-phenylethyl) N-phenylcarbamate, phenyl-carbamic acid 2,2,2-trifluoro-1-phenyl-ethyl ester, 635-393-3
| Molecular Formula | C15H12F3NO2 |
|---|---|
| Molecular Weight | 295.08 g/mol |
| LogP | 4.5387 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 295.082 |
| Heavy Atoms | 21 |
| Complexity | 584.8727 |
Chemical Identifiers
| CAS Number | 2648-11-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(C(F)(F)F)OC(=O)NC2=CC=CC=C2 |
Product Overview
Phenyl-carbamic acid 2,2,2-trifluoro-1-phenyl-ethyl ester (CAS 2648-11-5), with molecular formula C15H12F3NO2 and molecular weight 295.08 g/mol. IUPAC: (2,2,2-trifluoro-1-phenylethyl) N-phenylcarbamate.
Chemical Property Profile of Phenyl-carbamic acid 2,2,2-trifluoro-1-phenyl-ethyl ester
Property Insights of Phenyl-carbamic acid 2,2,2-trifluoro-1-phenyl-ethyl ester
The XLogP value of 4.5387 indicates that Phenyl-carbamic acid 2,2,2-trifluoro-1-phenyl-ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.33 Ų, Phenyl-carbamic acid 2,2,2-trifluoro-1-phenyl-ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenyl-carbamic acid 2,2,2-trifluoro-1-phenyl-ethyl ester 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 Phenyl-carbamic acid 2,2,2-trifluoro-1-phenyl-ethyl ester?
The CAS number of Phenyl-carbamic acid 2,2,2-trifluoro-1-phenyl-ethyl ester is 2648-11-5.
What is the molecular formula of Phenyl-carbamic acid 2,2,2-trifluoro-1-phenyl-ethyl ester?
The molecular formula of Phenyl-carbamic acid 2,2,2-trifluoro-1-phenyl-ethyl ester is C15H12F3NO2.
What is the molecular weight of Phenyl-carbamic acid 2,2,2-trifluoro-1-phenyl-ethyl ester?
The molecular weight of Phenyl-carbamic acid 2,2,2-trifluoro-1-phenyl-ethyl ester is 295.08 g/mol.
Where can I buy Phenyl-carbamic acid 2,2,2-trifluoro-1-phenyl-ethyl ester?
You can request a quote for Phenyl-carbamic acid 2,2,2-trifluoro-1-phenyl-ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenyl-carbamic acid 2,2,2-trifluoro-1-phenyl-ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phenyl-carbamic acid 2,2,2-trifluoro-1-phenyl-ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.