![Benzenamine, 2-methyl-5-[(trifluoromethyl)sulfonyl]- structure](/static/products/5167/51679-47-1.webp)
Benzenamine, 2-methyl-5-[(trifluoromethyl)sulfonyl]-
TL;DR: Benzenamine, 2-methyl-5-[(trifluoromethyl)sulfonyl]- (CAS 51679-47-1) is a chemical compound with molecular formula C8H8F3NO2S and molecular weight 239.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-5-(trifluoromethylsulfonyl)aniline
Also Known As: IDI1_008177, BAS 00312465, 2-methyl-5-(trifluoromethylsulfonyl)aniline, 2-Methyl-5-trifluoromethanesulfonyl-phenylamine, Benzenamine, 2-methyl-5-[(trifluoromethyl)sulfonyl]-
| Molecular Formula | C8H8F3NO2S |
|---|---|
| Molecular Weight | 239.02 g/mol |
| LogP | 1.87072 |
| Topological Polar Surface Area | 60.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 239.02278 |
| Heavy Atoms | 15 |
| Complexity | 479.15042 |
Chemical Identifiers
| CAS Number | 51679-47-1 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)S(=O)(=O)C(F)(F)F)N |
Product Overview
Benzenamine, 2-methyl-5-[(trifluoromethyl)sulfonyl]- (CAS 51679-47-1), with molecular formula C8H8F3NO2S and molecular weight 239.02 g/mol. IUPAC: 2-methyl-5-(trifluoromethylsulfonyl)aniline.
Chemical Property Profile of Benzenamine, 2-methyl-5-[(trifluoromethyl)sulfonyl]-
Property Insights of Benzenamine, 2-methyl-5-[(trifluoromethyl)sulfonyl]-
The XLogP value of 1.87072 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenamine, 2-methyl-5-[(trifluoromethyl)sulfonyl]-. The TPSA of 60.16 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzenamine, 2-methyl-5-[(trifluoromethyl)sulfonyl]-. Following Lipinski's Rule of Five, Benzenamine, 2-methyl-5-[(trifluoromethyl)sulfonyl]- 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 Benzenamine, 2-methyl-5-[(trifluoromethyl)sulfonyl]-?
The CAS number of Benzenamine, 2-methyl-5-[(trifluoromethyl)sulfonyl]- is 51679-47-1.
What is the molecular formula of Benzenamine, 2-methyl-5-[(trifluoromethyl)sulfonyl]-?
The molecular formula of Benzenamine, 2-methyl-5-[(trifluoromethyl)sulfonyl]- is C8H8F3NO2S.
What is the molecular weight of Benzenamine, 2-methyl-5-[(trifluoromethyl)sulfonyl]-?
The molecular weight of Benzenamine, 2-methyl-5-[(trifluoromethyl)sulfonyl]- is 239.02 g/mol.
Where can I buy Benzenamine, 2-methyl-5-[(trifluoromethyl)sulfonyl]-?
You can request a quote for Benzenamine, 2-methyl-5-[(trifluoromethyl)sulfonyl]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenamine, 2-methyl-5-[(trifluoromethyl)sulfonyl]-?
Yes, KEHONG BIO provides custom synthesis services for Benzenamine, 2-methyl-5-[(trifluoromethyl)sulfonyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.