N-(2,4-Dinitrophenyl)alanine
TL;DR: N-(2,4-Dinitrophenyl)alanine (CAS 349-05-3) is a chemical compound with molecular formula C9H9N3O6 and molecular weight 255.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,4-dinitroanilino)propanoic acid
Also Known As: Dnp-L-alanine, Dnp-alanine, n2ph-ala-oh, N-Dnp-L-alanine, N-(2,4-Dinitrophenyl)-L-alanine
| Molecular Formula | C9H9N3O6 |
|---|---|
| Molecular Weight | 255.05 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 141.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 255.04913 |
| Heavy Atoms | 18 |
| Complexity | 349.0 |
Chemical Identifiers
| CAS Number | 349-05-3 |
|---|---|
| SMILES | CC(C(=O)O)NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | KKHLKORVTUUSBC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(2,4-Dinitrophenyl)alanine (CAS 349-05-3), with molecular formula C9H9N3O6 and molecular weight 255.05 g/mol. IUPAC: 2-(2,4-dinitroanilino)propanoic acid.
Chemical Property Profile of N-(2,4-Dinitrophenyl)alanine
Property Insights of N-(2,4-Dinitrophenyl)alanine
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2,4-Dinitrophenyl)alanine. The TPSA of 141.0 Ų indicates high polarity, suggesting N-(2,4-Dinitrophenyl)alanine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-(2,4-Dinitrophenyl)alanine 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)alanine?
The CAS number of N-(2,4-Dinitrophenyl)alanine is 349-05-3.
What is the molecular formula of N-(2,4-Dinitrophenyl)alanine?
The molecular formula of N-(2,4-Dinitrophenyl)alanine is C9H9N3O6.
What is the molecular weight of N-(2,4-Dinitrophenyl)alanine?
The molecular weight of N-(2,4-Dinitrophenyl)alanine is 255.05 g/mol.
Where can I buy N-(2,4-Dinitrophenyl)alanine?
You can request a quote for N-(2,4-Dinitrophenyl)alanine 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)alanine?
Yes, KEHONG BIO provides custom synthesis services for N-(2,4-Dinitrophenyl)alanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.