1,1,1-Trifluoro-N-phenylmethanesulfonamide
TL;DR: 1,1,1-Trifluoro-N-phenylmethanesulfonamide (CAS 456-64-4) is a chemical compound with molecular formula C7H6F3NO2S and molecular weight 225.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1,1-trifluoro-N-phenylmethanesulfonamide
Also Known As: 1,1,1-trifluoro-n-phenylmethanesulfonamide, N-Phenyltriflamide, Trifluoromethanesulfonanilide, Phenyltriflamide, phenyl triflamide
| Molecular Formula | C7H6F3NO2S |
|---|---|
| Molecular Weight | 225.01 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 54.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 225.00714 |
| Heavy Atoms | 14 |
| Complexity | 274.0 |
Chemical Identifiers
| CAS Number | 456-64-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)NS(=O)(=O)C(F)(F)F |
| InChIKey | OXDSKEQSEGDAFN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,1,1-Trifluoro-N-phenylmethanesulfonamide (CAS 456-64-4), with molecular formula C7H6F3NO2S and molecular weight 225.01 g/mol. IUPAC: 1,1,1-trifluoro-N-phenylmethanesulfonamide.
Chemical Property Profile of 1,1,1-Trifluoro-N-phenylmethanesulfonamide
Property Insights of 1,1,1-Trifluoro-N-phenylmethanesulfonamide
The XLogP value of 3.0 indicates that 1,1,1-Trifluoro-N-phenylmethanesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.6 Ų, 1,1,1-Trifluoro-N-phenylmethanesulfonamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1,1-Trifluoro-N-phenylmethanesulfonamide has 1 hydrogen bond donor(s) and 6 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 1,1,1-Trifluoro-N-phenylmethanesulfonamide?
The CAS number of 1,1,1-Trifluoro-N-phenylmethanesulfonamide is 456-64-4.
What is the molecular formula of 1,1,1-Trifluoro-N-phenylmethanesulfonamide?
The molecular formula of 1,1,1-Trifluoro-N-phenylmethanesulfonamide is C7H6F3NO2S.
What is the molecular weight of 1,1,1-Trifluoro-N-phenylmethanesulfonamide?
The molecular weight of 1,1,1-Trifluoro-N-phenylmethanesulfonamide is 225.01 g/mol.
Where can I buy 1,1,1-Trifluoro-N-phenylmethanesulfonamide?
You can request a quote for 1,1,1-Trifluoro-N-phenylmethanesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1,1-Trifluoro-N-phenylmethanesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 1,1,1-Trifluoro-N-phenylmethanesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.