N~1~-Benzyl-4-(trifluoromethyl)benzene-1,2-diamine
TL;DR: N~1~-Benzyl-4-(trifluoromethyl)benzene-1,2-diamine (CAS 33643-64-0) is a chemical compound with molecular formula C14H13F3N2 and molecular weight 266.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-N-benzyl-4-(trifluoromethyl)benzene-1,2-diamine
Also Known As: N*1*-Benzyl-4-trifluoromethyl-benzene-1,2-diamine, n1-benzyl-4-(trifluoromethyl)benzene-1,2-diamine, 1-N-benzyl-4-(trifluoromethyl)benzene-1,2-diamine, IDI1_007827, N~1~-Benzyl-4-(trifluoromethyl)benzene-1,2-diamine
| Molecular Formula | C14H13F3N2 |
|---|---|
| Molecular Weight | 266.10 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 38.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 266.1031 |
| Heavy Atoms | 19 |
| Complexity | 274.0 |
Chemical Identifiers
| CAS Number | 33643-64-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNC2=C(C=C(C=C2)C(F)(F)F)N |
| InChIKey | UAUSRDXUDXPKCZ-UHFFFAOYSA-N |
Product Overview
N~1~-Benzyl-4-(trifluoromethyl)benzene-1,2-diamine (CAS 33643-64-0), with molecular formula C14H13F3N2 and molecular weight 266.10 g/mol. IUPAC: 1-N-benzyl-4-(trifluoromethyl)benzene-1,2-diamine.
Chemical Property Profile of N~1~-Benzyl-4-(trifluoromethyl)benzene-1,2-diamine
Property Insights of N~1~-Benzyl-4-(trifluoromethyl)benzene-1,2-diamine
The XLogP value of 3.6 indicates that N~1~-Benzyl-4-(trifluoromethyl)benzene-1,2-diamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.1 Ų, N~1~-Benzyl-4-(trifluoromethyl)benzene-1,2-diamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N~1~-Benzyl-4-(trifluoromethyl)benzene-1,2-diamine has 2 hydrogen bond donor(s) and 5 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~1~-Benzyl-4-(trifluoromethyl)benzene-1,2-diamine?
The CAS number of N~1~-Benzyl-4-(trifluoromethyl)benzene-1,2-diamine is 33643-64-0.
What is the molecular formula of N~1~-Benzyl-4-(trifluoromethyl)benzene-1,2-diamine?
The molecular formula of N~1~-Benzyl-4-(trifluoromethyl)benzene-1,2-diamine is C14H13F3N2.
What is the molecular weight of N~1~-Benzyl-4-(trifluoromethyl)benzene-1,2-diamine?
The molecular weight of N~1~-Benzyl-4-(trifluoromethyl)benzene-1,2-diamine is 266.10 g/mol.
Where can I buy N~1~-Benzyl-4-(trifluoromethyl)benzene-1,2-diamine?
You can request a quote for N~1~-Benzyl-4-(trifluoromethyl)benzene-1,2-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N~1~-Benzyl-4-(trifluoromethyl)benzene-1,2-diamine?
Yes, KEHONG BIO provides custom synthesis services for N~1~-Benzyl-4-(trifluoromethyl)benzene-1,2-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.