N-benzyl-4-fluoroaniline
TL;DR: N-benzyl-4-fluoroaniline (CAS 370-77-4) is a chemical compound with molecular formula C13H12FN and molecular weight 201.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-4-fluoroaniline
Also Known As: N-benzyl-4-fluoroaniline, N-benzyl-4-fluoro-aniline, N-Benzyl-p-fluoroaniline, N-Benzyl-4-fluoroaniline Hydrochloride, Benzyl(4-fluorophenyl)amine
| Molecular Formula | C13H12FN |
|---|---|
| Molecular Weight | 201.10 g/mol |
| LogP | 3.4378 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 201.09538 |
| Heavy Atoms | 15 |
| Complexity | 408.3109 |
Chemical Identifiers
| CAS Number | 370-77-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNC2=CC=C(C=C2)F |
Product Overview
N-benzyl-4-fluoroaniline (CAS 370-77-4), with molecular formula C13H12FN and molecular weight 201.10 g/mol. IUPAC: N-benzyl-4-fluoroaniline.
Chemical Property Profile of N-benzyl-4-fluoroaniline
Property Insights of N-benzyl-4-fluoroaniline
The XLogP value of 3.4378 indicates that N-benzyl-4-fluoroaniline 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-benzyl-4-fluoroaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-benzyl-4-fluoroaniline 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-benzyl-4-fluoroaniline?
The CAS number of N-benzyl-4-fluoroaniline is 370-77-4.
What is the molecular formula of N-benzyl-4-fluoroaniline?
The molecular formula of N-benzyl-4-fluoroaniline is C13H12FN.
What is the molecular weight of N-benzyl-4-fluoroaniline?
The molecular weight of N-benzyl-4-fluoroaniline is 201.10 g/mol.
Where can I buy N-benzyl-4-fluoroaniline?
You can request a quote for N-benzyl-4-fluoroaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-benzyl-4-fluoroaniline?
Yes, KEHONG BIO provides custom synthesis services for N-benzyl-4-fluoroaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.