![3-(3-nitrophenyl)-3-[(2,2,2-trifluoroacetyl)amino]propanoic Acid structure](/static/products/4390/439095-29-1.webp)
3-(3-nitrophenyl)-3-[(2,2,2-trifluoroacetyl)amino]propanoic Acid
TL;DR: 3-(3-nitrophenyl)-3-[(2,2,2-trifluoroacetyl)amino]propanoic Acid (CAS 439095-29-1) is a chemical compound with molecular formula C11H9F3N2O5 and molecular weight 306.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-nitrophenyl)-3-[(2,2,2-trifluoroacetyl)amino]propanoic acid
Also Known As: 3-(3-nitrophenyl)-3-[(2,2,2-trifluoroacetyl)amino]propanoic Acid, 3-(3-nitrophenyl)-3-(2,2,2-trifluoroacetamido)propanoic acid, 1T-0655, 3-(3-nitrophenyl)-3-(2,2,2-trifluoroacetamido)propanoicacid
| Molecular Formula | C11H9F3N2O5 |
|---|---|
| Molecular Weight | 306.05 g/mol |
| LogP | 1.7891 |
| Topological Polar Surface Area | 109.54 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 306.04636 |
| Heavy Atoms | 21 |
| Complexity | 573.2223 |
Chemical Identifiers
| CAS Number | 439095-29-1 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])C(CC(=O)O)NC(=O)C(F)(F)F |
Product Overview
3-(3-nitrophenyl)-3-[(2,2,2-trifluoroacetyl)amino]propanoic Acid (CAS 439095-29-1), with molecular formula C11H9F3N2O5 and molecular weight 306.05 g/mol. IUPAC: 3-(3-nitrophenyl)-3-[(2,2,2-trifluoroacetyl)amino]propanoic acid.
Chemical Property Profile of 3-(3-nitrophenyl)-3-[(2,2,2-trifluoroacetyl)amino]propanoic Acid
Property Insights of 3-(3-nitrophenyl)-3-[(2,2,2-trifluoroacetyl)amino]propanoic Acid
The XLogP value of 1.7891 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(3-nitrophenyl)-3-[(2,2,2-trifluoroacetyl)amino]propanoic Acid. The TPSA of 109.54 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(3-nitrophenyl)-3-[(2,2,2-trifluoroacetyl)amino]propanoic Acid. Following Lipinski's Rule of Five, 3-(3-nitrophenyl)-3-[(2,2,2-trifluoroacetyl)amino]propanoic Acid has 2 hydrogen bond donor(s) and 4 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 3-(3-nitrophenyl)-3-[(2,2,2-trifluoroacetyl)amino]propanoic Acid?
The CAS number of 3-(3-nitrophenyl)-3-[(2,2,2-trifluoroacetyl)amino]propanoic Acid is 439095-29-1.
What is the molecular formula of 3-(3-nitrophenyl)-3-[(2,2,2-trifluoroacetyl)amino]propanoic Acid?
The molecular formula of 3-(3-nitrophenyl)-3-[(2,2,2-trifluoroacetyl)amino]propanoic Acid is C11H9F3N2O5.
What is the molecular weight of 3-(3-nitrophenyl)-3-[(2,2,2-trifluoroacetyl)amino]propanoic Acid?
The molecular weight of 3-(3-nitrophenyl)-3-[(2,2,2-trifluoroacetyl)amino]propanoic Acid is 306.05 g/mol.
Where can I buy 3-(3-nitrophenyl)-3-[(2,2,2-trifluoroacetyl)amino]propanoic Acid?
You can request a quote for 3-(3-nitrophenyl)-3-[(2,2,2-trifluoroacetyl)amino]propanoic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3-nitrophenyl)-3-[(2,2,2-trifluoroacetyl)amino]propanoic Acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(3-nitrophenyl)-3-[(2,2,2-trifluoroacetyl)amino]propanoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.