N-(3,4-difluorophenyl)-3,4-difluoroaniline
TL;DR: N-(3,4-difluorophenyl)-3,4-difluoroaniline (CAS 330-48-3) is a chemical compound with molecular formula C12H7F4N and molecular weight 241.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3,4-difluorophenyl)-3,4-difluoroaniline
Also Known As: N- -3,4-difluoro-aniline, bis-(3,4-difluoro-phenyl)-amine, N-(3,4-difluorophenyl)-3,4-difluoroaniline, Benzenamine,N-(3,4-difluorophenyl)-3,4-difluoro-, N-(3,4-Difluorophenyl)-3,4-Difluoro-Benzenamine
| Molecular Formula | C12H7F4N |
|---|---|
| Molecular Weight | 241.05 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 241.05147 |
| Heavy Atoms | 17 |
| Complexity | 227.0 |
Chemical Identifiers
| CAS Number | 330-48-3 |
|---|---|
| SMILES | C1=CC(=C(C=C1NC2=CC(=C(C=C2)F)F)F)F |
| InChIKey | ZRJAVMVAQXIURD-UHFFFAOYSA-N |
Product Overview
N-(3,4-difluorophenyl)-3,4-difluoroaniline (CAS 330-48-3), with molecular formula C12H7F4N and molecular weight 241.05 g/mol. IUPAC: N-(3,4-difluorophenyl)-3,4-difluoroaniline.
Chemical Property Profile of N-(3,4-difluorophenyl)-3,4-difluoroaniline
Property Insights of N-(3,4-difluorophenyl)-3,4-difluoroaniline
The XLogP value of 4.1 indicates that N-(3,4-difluorophenyl)-3,4-difluoroaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.0 Ų, N-(3,4-difluorophenyl)-3,4-difluoroaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3,4-difluorophenyl)-3,4-difluoroaniline has 1 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-(3,4-difluorophenyl)-3,4-difluoroaniline?
The CAS number of N-(3,4-difluorophenyl)-3,4-difluoroaniline is 330-48-3.
What is the molecular formula of N-(3,4-difluorophenyl)-3,4-difluoroaniline?
The molecular formula of N-(3,4-difluorophenyl)-3,4-difluoroaniline is C12H7F4N.
What is the molecular weight of N-(3,4-difluorophenyl)-3,4-difluoroaniline?
The molecular weight of N-(3,4-difluorophenyl)-3,4-difluoroaniline is 241.05 g/mol.
Where can I buy N-(3,4-difluorophenyl)-3,4-difluoroaniline?
You can request a quote for N-(3,4-difluorophenyl)-3,4-difluoroaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3,4-difluorophenyl)-3,4-difluoroaniline?
Yes, KEHONG BIO provides custom synthesis services for N-(3,4-difluorophenyl)-3,4-difluoroaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.