N-(5-Fluoro-2,4-dinitrophenyl)-L-alanine
TL;DR: N-(5-Fluoro-2,4-dinitrophenyl)-L-alanine (CAS 346-48-5) is a chemical compound with molecular formula C9H8FN3O6 and molecular weight 273.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-(5-fluoro-2,4-dinitroanilino)propanoic acid
Also Known As: FDNPA, 1-Fluoro-2,4-dinitrophenyl-5-alanine, N-(5-Fluoro-2,4-dinitrophenyl)-L-alanine, (2S)-2-(5-fluoro-2,4-dinitroanilino)propanoic acid, L-Alanine, N-(5-fluoro-2,4-dinitrophenyl)-
| Molecular Formula | C9H8FN3O6 |
|---|---|
| Molecular Weight | 273.04 g/mol |
| LogP | 1.5271 |
| Topological Polar Surface Area | 135.61 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 273.0397 |
| Heavy Atoms | 19 |
| Complexity | 561.1311 |
Chemical Identifiers
| CAS Number | 346-48-5 |
|---|---|
| SMILES | C[C@@H](C(=O)O)NC1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])F |
Product Overview
N-(5-Fluoro-2,4-dinitrophenyl)-L-alanine (CAS 346-48-5), with molecular formula C9H8FN3O6 and molecular weight 273.04 g/mol. IUPAC: (2S)-2-(5-fluoro-2,4-dinitroanilino)propanoic acid.
Chemical Property Profile of N-(5-Fluoro-2,4-dinitrophenyl)-L-alanine
Property Insights of N-(5-Fluoro-2,4-dinitrophenyl)-L-alanine
The XLogP value of 1.5271 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(5-Fluoro-2,4-dinitrophenyl)-L-alanine. The TPSA of 135.61 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(5-Fluoro-2,4-dinitrophenyl)-L-alanine. Following Lipinski's Rule of Five, N-(5-Fluoro-2,4-dinitrophenyl)-L-alanine has 2 hydrogen bond donor(s) and 6 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-(5-Fluoro-2,4-dinitrophenyl)-L-alanine?
The CAS number of N-(5-Fluoro-2,4-dinitrophenyl)-L-alanine is 346-48-5.
What is the molecular formula of N-(5-Fluoro-2,4-dinitrophenyl)-L-alanine?
The molecular formula of N-(5-Fluoro-2,4-dinitrophenyl)-L-alanine is C9H8FN3O6.
What is the molecular weight of N-(5-Fluoro-2,4-dinitrophenyl)-L-alanine?
The molecular weight of N-(5-Fluoro-2,4-dinitrophenyl)-L-alanine is 273.04 g/mol.
Where can I buy N-(5-Fluoro-2,4-dinitrophenyl)-L-alanine?
You can request a quote for N-(5-Fluoro-2,4-dinitrophenyl)-L-alanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(5-Fluoro-2,4-dinitrophenyl)-L-alanine?
Yes, KEHONG BIO provides custom synthesis services for N-(5-Fluoro-2,4-dinitrophenyl)-L-alanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.