N-methyl-3-(trifluoromethyl)aniline
TL;DR: N-methyl-3-(trifluoromethyl)aniline (CAS 2026-70-2) is a chemical compound with molecular formula C8H8F3N and molecular weight 175.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-methyl-3-(trifluoromethyl)aniline
Also Known As: N-methyl-3-(trifluoromethyl)aniline, METHYL- -AMINE, methyl-(3-trifluoromethyl-phenyl)-amine, 2,4-DICHLOROSTYRENE, 3-(Methylamino)benzotrifluoride
| Molecular Formula | C8H8F3N |
|---|---|
| Molecular Weight | 175.06 g/mol |
| LogP | 2.7471 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 175.06088 |
| Heavy Atoms | 12 |
| Complexity | 267.25064 |
Chemical Identifiers
| CAS Number | 2026-70-2 |
|---|---|
| SMILES | CNC1=CC=CC(=C1)C(F)(F)F |
Product Overview
N-methyl-3-(trifluoromethyl)aniline (CAS 2026-70-2), with molecular formula C8H8F3N and molecular weight 175.06 g/mol. IUPAC: N-methyl-3-(trifluoromethyl)aniline.
Chemical Property Profile of N-methyl-3-(trifluoromethyl)aniline
Property Insights of N-methyl-3-(trifluoromethyl)aniline
The XLogP value of 2.7471 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-methyl-3-(trifluoromethyl)aniline. With a topological polar surface area (TPSA) of 12.03 Ų, N-methyl-3-(trifluoromethyl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-methyl-3-(trifluoromethyl)aniline has 1 hydrogen bond donor(s) and 1 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 N-methyl-3-(trifluoromethyl)aniline?
The CAS number of N-methyl-3-(trifluoromethyl)aniline is 2026-70-2.
What is the molecular formula of N-methyl-3-(trifluoromethyl)aniline?
The molecular formula of N-methyl-3-(trifluoromethyl)aniline is C8H8F3N.
What is the molecular weight of N-methyl-3-(trifluoromethyl)aniline?
The molecular weight of N-methyl-3-(trifluoromethyl)aniline is 175.06 g/mol.
Where can I buy N-methyl-3-(trifluoromethyl)aniline?
You can request a quote for N-methyl-3-(trifluoromethyl)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-methyl-3-(trifluoromethyl)aniline?
Yes, KEHONG BIO provides custom synthesis services for N-methyl-3-(trifluoromethyl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.