N-2-Nitrophenyl-2,5-difluoroaniline
TL;DR: N-2-Nitrophenyl-2,5-difluoroaniline (CAS 500302-15-8) is a chemical compound with molecular formula C12H8F2N2O2 and molecular weight 250.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-difluoro-N-(2-nitrophenyl)aniline
Also Known As: NCIOpen2_006021, N-2-Nitrophenyl-2,5-difluoroaniline, 2,5-difluoro-N-(2-nitrophenyl)aniline, Benzenamine, 2,5-difluoro-N-(2-nitrophenyl)-
| Molecular Formula | C12H8F2N2O2 |
|---|---|
| Molecular Weight | 250.06 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 57.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 250.05539 |
| Heavy Atoms | 18 |
| Complexity | 298.0 |
Chemical Identifiers
| CAS Number | 500302-15-8 |
|---|---|
| SMILES | C1=CC=C(C(=C1)NC2=C(C=CC(=C2)F)F)[N+](=O)[O-] |
| InChIKey | WUMGHQOJHLPRFN-UHFFFAOYSA-N |
Product Overview
N-2-Nitrophenyl-2,5-difluoroaniline (CAS 500302-15-8), with molecular formula C12H8F2N2O2 and molecular weight 250.06 g/mol. IUPAC: 2,5-difluoro-N-(2-nitrophenyl)aniline.
Chemical Property Profile of N-2-Nitrophenyl-2,5-difluoroaniline
Property Insights of N-2-Nitrophenyl-2,5-difluoroaniline
The XLogP value of 4.0 indicates that N-2-Nitrophenyl-2,5-difluoroaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.9 Ų, N-2-Nitrophenyl-2,5-difluoroaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-2-Nitrophenyl-2,5-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-2-Nitrophenyl-2,5-difluoroaniline?
The CAS number of N-2-Nitrophenyl-2,5-difluoroaniline is 500302-15-8.
What is the molecular formula of N-2-Nitrophenyl-2,5-difluoroaniline?
The molecular formula of N-2-Nitrophenyl-2,5-difluoroaniline is C12H8F2N2O2.
What is the molecular weight of N-2-Nitrophenyl-2,5-difluoroaniline?
The molecular weight of N-2-Nitrophenyl-2,5-difluoroaniline is 250.06 g/mol.
Where can I buy N-2-Nitrophenyl-2,5-difluoroaniline?
You can request a quote for N-2-Nitrophenyl-2,5-difluoroaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-2-Nitrophenyl-2,5-difluoroaniline?
Yes, KEHONG BIO provides custom synthesis services for N-2-Nitrophenyl-2,5-difluoroaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.