N-Allyl-3-(trifluoromethyl)aniline
TL;DR: N-Allyl-3-(trifluoromethyl)aniline (CAS 61219-93-0) is a chemical compound with molecular formula C10H10F3N and molecular weight 201.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-prop-2-enyl-3-(trifluoromethyl)aniline
Also Known As: N-Allyl-3-(trifluoromethyl)aniline, N-allyl-3- aniline, EINECS 262-668-1, N-allyl-m-trifluoromethylaniline, N-prop-2-enyl-3-(trifluoromethyl)aniline
| Molecular Formula | C10H10F3N |
|---|---|
| Molecular Weight | 201.08 g/mol |
| LogP | 3.3033 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 201.07654 |
| Heavy Atoms | 14 |
| Complexity | 317.3883 |
Chemical Identifiers
| CAS Number | 61219-93-0 |
|---|---|
| SMILES | C=CCNC1=CC=CC(=C1)C(F)(F)F |
Product Overview
N-Allyl-3-(trifluoromethyl)aniline (CAS 61219-93-0), with molecular formula C10H10F3N and molecular weight 201.08 g/mol. IUPAC: N-prop-2-enyl-3-(trifluoromethyl)aniline.
Chemical Property Profile of N-Allyl-3-(trifluoromethyl)aniline
Property Insights of N-Allyl-3-(trifluoromethyl)aniline
The XLogP value of 3.3033 indicates that N-Allyl-3-(trifluoromethyl)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.03 Ų, N-Allyl-3-(trifluoromethyl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Allyl-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-Allyl-3-(trifluoromethyl)aniline?
The CAS number of N-Allyl-3-(trifluoromethyl)aniline is 61219-93-0.
What is the molecular formula of N-Allyl-3-(trifluoromethyl)aniline?
The molecular formula of N-Allyl-3-(trifluoromethyl)aniline is C10H10F3N.
What is the molecular weight of N-Allyl-3-(trifluoromethyl)aniline?
The molecular weight of N-Allyl-3-(trifluoromethyl)aniline is 201.08 g/mol.
Where can I buy N-Allyl-3-(trifluoromethyl)aniline?
You can request a quote for N-Allyl-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-Allyl-3-(trifluoromethyl)aniline?
Yes, KEHONG BIO provides custom synthesis services for N-Allyl-3-(trifluoromethyl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.