4-Difluoromethanesulfonylaniline
TL;DR: 4-Difluoromethanesulfonylaniline (CAS 24906-77-2) is a chemical compound with molecular formula C7H7F2NO2S and molecular weight 207.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(difluoromethylsulfonyl)aniline
Also Known As: 4-difluoromethanesulfonylaniline, 4-[(difluoromethyl)sulfonyl]aniline, 4-(difluoromethylsulfonyl)aniline, 4-((Difluoromethyl)sulfonyl)aniline, p-difluoromethylsulfonylaniline
| Molecular Formula | C7H7F2NO2S |
|---|---|
| Molecular Weight | 207.02 g/mol |
| LogP | 1.2651 |
| Topological Polar Surface Area | 60.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 207.01656 |
| Heavy Atoms | 13 |
| Complexity | 385.4585 |
Chemical Identifiers
| CAS Number | 24906-77-2 |
|---|---|
| SMILES | C1=CC(=CC=C1N)S(=O)(=O)C(F)F |
Product Overview
4-Difluoromethanesulfonylaniline (CAS 24906-77-2), with molecular formula C7H7F2NO2S and molecular weight 207.02 g/mol. IUPAC: 4-(difluoromethylsulfonyl)aniline.
Chemical Property Profile of 4-Difluoromethanesulfonylaniline
Property Insights of 4-Difluoromethanesulfonylaniline
The XLogP value of 1.2651 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Difluoromethanesulfonylaniline. The TPSA of 60.16 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Difluoromethanesulfonylaniline. Following Lipinski's Rule of Five, 4-Difluoromethanesulfonylaniline 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 4-Difluoromethanesulfonylaniline?
The CAS number of 4-Difluoromethanesulfonylaniline is 24906-77-2.
What is the molecular formula of 4-Difluoromethanesulfonylaniline?
The molecular formula of 4-Difluoromethanesulfonylaniline is C7H7F2NO2S.
What is the molecular weight of 4-Difluoromethanesulfonylaniline?
The molecular weight of 4-Difluoromethanesulfonylaniline is 207.02 g/mol.
Where can I buy 4-Difluoromethanesulfonylaniline?
You can request a quote for 4-Difluoromethanesulfonylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Difluoromethanesulfonylaniline?
Yes, KEHONG BIO provides custom synthesis services for 4-Difluoromethanesulfonylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.