N-(2,4-Dinitrophenyl)-L-valine
TL;DR: N-(2,4-Dinitrophenyl)-L-valine (CAS 1694-97-9) is a chemical compound with molecular formula C11H13N3O6 and molecular weight 283.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-(2,4-dinitroanilino)-3-methylbutanoic acid
Also Known As: N-(2,4-Dinitrophenyl)-L-valine, N-Dnp-L-valine, Dnp-L-valine, Dnp-Val-OH, N-Dinitrophenyl-l-valine
| Molecular Formula | C11H13N3O6 |
|---|---|
| Molecular Weight | 283.08 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 141.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 283.08044 |
| Heavy Atoms | 20 |
| Complexity | 389.0 |
Chemical Identifiers
| CAS Number | 1694-97-9 |
|---|---|
| SMILES | CC(C)[C@@H](C(=O)O)NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | AYLCDVYHZOZQKM-JTQLQIEISA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(2,4-Dinitrophenyl)-L-valine (CAS 1694-97-9), with molecular formula C11H13N3O6 and molecular weight 283.08 g/mol. IUPAC: (2S)-2-(2,4-dinitroanilino)-3-methylbutanoic acid.
Chemical Property Profile of N-(2,4-Dinitrophenyl)-L-valine
Property Insights of N-(2,4-Dinitrophenyl)-L-valine
The XLogP value of 3.2 indicates that N-(2,4-Dinitrophenyl)-L-valine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 141.0 Ų indicates high polarity, suggesting N-(2,4-Dinitrophenyl)-L-valine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-(2,4-Dinitrophenyl)-L-valine has 2 hydrogen bond donor(s) and 7 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-(2,4-Dinitrophenyl)-L-valine?
The CAS number of N-(2,4-Dinitrophenyl)-L-valine is 1694-97-9.
What is the molecular formula of N-(2,4-Dinitrophenyl)-L-valine?
The molecular formula of N-(2,4-Dinitrophenyl)-L-valine is C11H13N3O6.
What is the molecular weight of N-(2,4-Dinitrophenyl)-L-valine?
The molecular weight of N-(2,4-Dinitrophenyl)-L-valine is 283.08 g/mol.
Where can I buy N-(2,4-Dinitrophenyl)-L-valine?
You can request a quote for N-(2,4-Dinitrophenyl)-L-valine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2,4-Dinitrophenyl)-L-valine?
Yes, KEHONG BIO provides custom synthesis services for N-(2,4-Dinitrophenyl)-L-valine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.