4-(Trifluoromethyl)phenylurethane
TL;DR: 4-(Trifluoromethyl)phenylurethane (CAS 23794-73-2) 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.
ethyl N-[4-(trifluoromethyl)phenyl]carbamate
Also Known As: 4-(Trifluoromethyl)phenylurethane, ethyl N-[4-(trifluoromethyl)phenyl]carbamate, Ethyl (4-(trifluoromethyl)phenyl)carbamate, 4-(trifluoromethyl)urethane, 4-(trifluoromethylphenylurethane)
| Molecular Formula | C10H10F3NO2 |
|---|---|
| Molecular Weight | 233.07 g/mol |
| LogP | 3.2738 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 233.06636 |
| Heavy Atoms | 16 |
| Complexity | 359.32205 |
Chemical Identifiers
| CAS Number | 23794-73-2 |
|---|---|
| SMILES | CCOC(=O)NC1=CC=C(C=C1)C(F)(F)F |
Product Overview
4-(Trifluoromethyl)phenylurethane (CAS 23794-73-2), with molecular formula C10H10F3NO2 and molecular weight 233.07 g/mol. IUPAC: ethyl N-[4-(trifluoromethyl)phenyl]carbamate.
Chemical Property Profile of 4-(Trifluoromethyl)phenylurethane
Property Insights of 4-(Trifluoromethyl)phenylurethane
The XLogP value of 3.2738 indicates that 4-(Trifluoromethyl)phenylurethane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.33 Ų, 4-(Trifluoromethyl)phenylurethane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Trifluoromethyl)phenylurethane 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 4-(Trifluoromethyl)phenylurethane?
The CAS number of 4-(Trifluoromethyl)phenylurethane is 23794-73-2.
What is the molecular formula of 4-(Trifluoromethyl)phenylurethane?
The molecular formula of 4-(Trifluoromethyl)phenylurethane is C10H10F3NO2.
What is the molecular weight of 4-(Trifluoromethyl)phenylurethane?
The molecular weight of 4-(Trifluoromethyl)phenylurethane is 233.07 g/mol.
Where can I buy 4-(Trifluoromethyl)phenylurethane?
You can request a quote for 4-(Trifluoromethyl)phenylurethane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Trifluoromethyl)phenylurethane?
Yes, KEHONG BIO provides custom synthesis services for 4-(Trifluoromethyl)phenylurethane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.