2-Amino-5-chloro-3-nitrobenzotrifluoride
TL;DR: 2-Amino-5-chloro-3-nitrobenzotrifluoride (CAS 62924-50-9) is a chemical compound with molecular formula C7H4ClF3N2O2 and molecular weight 239.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-2-nitro-6-(trifluoromethyl)aniline
Also Known As: 2-Amino-5-chloro-3-nitrobenzotrifluoride, 4-chloro-2-nitro-6-(trifluoromethyl)aniline, 2-amino-3-nitro-5-chlorobenzotrifluoride, 2-amino-3-nitro-5-chloro-benzotrifluoride, 4-Chloro-2-nitro-6-trifluoromethylaniline
| Molecular Formula | C7H4ClF3N2O2 |
|---|---|
| Molecular Weight | 239.99 g/mol |
| LogP | 2.8492 |
| Topological Polar Surface Area | 69.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 239.99133 |
| Heavy Atoms | 15 |
| Complexity | 419.4317 |
Chemical Identifiers
| CAS Number | 62924-50-9 |
|---|---|
| SMILES | C1=C(C=C(C(=C1C(F)(F)F)N)[N+](=O)[O-])Cl |
Product Overview
2-Amino-5-chloro-3-nitrobenzotrifluoride (CAS 62924-50-9), with molecular formula C7H4ClF3N2O2 and molecular weight 239.99 g/mol. IUPAC: 4-chloro-2-nitro-6-(trifluoromethyl)aniline.
Chemical Property Profile of 2-Amino-5-chloro-3-nitrobenzotrifluoride
Property Insights of 2-Amino-5-chloro-3-nitrobenzotrifluoride
The XLogP value of 2.8492 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Amino-5-chloro-3-nitrobenzotrifluoride. The TPSA of 69.16 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Amino-5-chloro-3-nitrobenzotrifluoride. Following Lipinski's Rule of Five, 2-Amino-5-chloro-3-nitrobenzotrifluoride has 1 hydrogen bond donor(s) and 3 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 2-Amino-5-chloro-3-nitrobenzotrifluoride?
The CAS number of 2-Amino-5-chloro-3-nitrobenzotrifluoride is 62924-50-9.
What is the molecular formula of 2-Amino-5-chloro-3-nitrobenzotrifluoride?
The molecular formula of 2-Amino-5-chloro-3-nitrobenzotrifluoride is C7H4ClF3N2O2.
What is the molecular weight of 2-Amino-5-chloro-3-nitrobenzotrifluoride?
The molecular weight of 2-Amino-5-chloro-3-nitrobenzotrifluoride is 239.99 g/mol.
Where can I buy 2-Amino-5-chloro-3-nitrobenzotrifluoride?
You can request a quote for 2-Amino-5-chloro-3-nitrobenzotrifluoride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Amino-5-chloro-3-nitrobenzotrifluoride?
Yes, KEHONG BIO provides custom synthesis services for 2-Amino-5-chloro-3-nitrobenzotrifluoride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.