![{[2-(Trifluoromethyl)phenyl]carbamoyl}methyl 2-fluorobenzoate structure](/static/products/808/808105-83-1.png)
{[2-(Trifluoromethyl)phenyl]carbamoyl}methyl 2-fluorobenzoate
TL;DR: {[2-(Trifluoromethyl)phenyl]carbamoyl}methyl 2-fluorobenzoate (CAS 808105-83-1) is a chemical compound with molecular formula C16H11F4NO3 and molecular weight 341.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl] 2-fluorobenzoate
Also Known As: {[2-(trifluoromethyl)phenyl]carbamoyl}methyl 2-fluorobenzoate, AB00758021-01, [2-oxo-2-[2-(trifluoromethyl)anilino]ethyl] 2-fluorobenzoate
| Molecular Formula | C16H11F4NO3 |
|---|---|
| Molecular Weight | 341.07 g/mol |
| LogP | 3.64 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 341.0675 |
| Heavy Atoms | 24 |
| Complexity | 758.9829 |
Chemical Identifiers
| CAS Number | 808105-83-1 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)OCC(=O)NC2=CC=CC=C2C(F)(F)F)F |
Product Overview
{[2-(Trifluoromethyl)phenyl]carbamoyl}methyl 2-fluorobenzoate (CAS 808105-83-1), with molecular formula C16H11F4NO3 and molecular weight 341.07 g/mol. IUPAC: [2-oxo-2-[2-(trifluoromethyl)anilino]ethyl] 2-fluorobenzoate.
Chemical Property Profile of {[2-(Trifluoromethyl)phenyl]carbamoyl}methyl 2-fluorobenzoate
Property Insights of {[2-(Trifluoromethyl)phenyl]carbamoyl}methyl 2-fluorobenzoate
The XLogP value of 3.64 indicates that {[2-(Trifluoromethyl)phenyl]carbamoyl}methyl 2-fluorobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, {[2-(Trifluoromethyl)phenyl]carbamoyl}methyl 2-fluorobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, {[2-(Trifluoromethyl)phenyl]carbamoyl}methyl 2-fluorobenzoate has 1 hydrogen bond donor(s) and 3 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-(Trifluoromethyl)phenyl]carbamoyl}methyl 2-fluorobenzoate?
The CAS number of {[2-(Trifluoromethyl)phenyl]carbamoyl}methyl 2-fluorobenzoate is 808105-83-1.
What is the molecular formula of {[2-(Trifluoromethyl)phenyl]carbamoyl}methyl 2-fluorobenzoate?
The molecular formula of {[2-(Trifluoromethyl)phenyl]carbamoyl}methyl 2-fluorobenzoate is C16H11F4NO3.
What is the molecular weight of {[2-(Trifluoromethyl)phenyl]carbamoyl}methyl 2-fluorobenzoate?
The molecular weight of {[2-(Trifluoromethyl)phenyl]carbamoyl}methyl 2-fluorobenzoate is 341.07 g/mol.
Where can I buy {[2-(Trifluoromethyl)phenyl]carbamoyl}methyl 2-fluorobenzoate?
You can request a quote for {[2-(Trifluoromethyl)phenyl]carbamoyl}methyl 2-fluorobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for {[2-(Trifluoromethyl)phenyl]carbamoyl}methyl 2-fluorobenzoate?
Yes, KEHONG BIO provides custom synthesis services for {[2-(Trifluoromethyl)phenyl]carbamoyl}methyl 2-fluorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.