![Methyl 4-[(2,4-dinitrophenyl)hydrazinylidene]-2-phenyl-butanoate structure](/static/products/6703/67031-13-4.webp)
Methyl 4-[(2,4-dinitrophenyl)hydrazinylidene]-2-phenyl-butanoate
TL;DR: Methyl 4-[(2,4-dinitrophenyl)hydrazinylidene]-2-phenyl-butanoate (CAS 67031-13-4) is a chemical compound with molecular formula C17H16N4O6 and molecular weight 372.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[(2,4-dinitrophenyl)hydrazinylidene]-2-phenylbutanoate
Also Known As: METHYL 4-[(2,4-DINITROPHENYL)HYDRAZINYLIDENE]-2-PHENYL-BUTANOATE, methyl 4-[(2,4-dinitrophenyl)hydrazinylidene]-2-phenylbutano, methyl 4-[(2,4-dinitrophenyl)hydrazinylidene]-2-phenylbutanoate, Methyl 4-[2-(2,4-dinitrophenyl)hydrazinylidene]-2-phenylbutanoate
| Molecular Formula | C17H16N4O6 |
|---|---|
| Molecular Weight | 372.11 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 142.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 372.107 |
| Heavy Atoms | 27 |
| Complexity | 553.0 |
Chemical Identifiers
| CAS Number | 67031-13-4 |
|---|---|
| SMILES | COC(=O)C(CC=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])C2=CC=CC=C2 |
| InChIKey | YNDSMHLHZQBPIR-UHFFFAOYSA-N |
Product Overview
Methyl 4-[(2,4-dinitrophenyl)hydrazinylidene]-2-phenyl-butanoate (CAS 67031-13-4), with molecular formula C17H16N4O6 and molecular weight 372.11 g/mol. IUPAC: methyl 4-[(2,4-dinitrophenyl)hydrazinylidene]-2-phenylbutanoate.
Chemical Property Profile of Methyl 4-[(2,4-dinitrophenyl)hydrazinylidene]-2-phenyl-butanoate
Property Insights of Methyl 4-[(2,4-dinitrophenyl)hydrazinylidene]-2-phenyl-butanoate
The XLogP value of 3.5 indicates that Methyl 4-[(2,4-dinitrophenyl)hydrazinylidene]-2-phenyl-butanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 142.0 Ų indicates high polarity, suggesting Methyl 4-[(2,4-dinitrophenyl)hydrazinylidene]-2-phenyl-butanoate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Methyl 4-[(2,4-dinitrophenyl)hydrazinylidene]-2-phenyl-butanoate has 1 hydrogen bond donor(s) and 8 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 Methyl 4-[(2,4-dinitrophenyl)hydrazinylidene]-2-phenyl-butanoate?
The CAS number of Methyl 4-[(2,4-dinitrophenyl)hydrazinylidene]-2-phenyl-butanoate is 67031-13-4.
What is the molecular formula of Methyl 4-[(2,4-dinitrophenyl)hydrazinylidene]-2-phenyl-butanoate?
The molecular formula of Methyl 4-[(2,4-dinitrophenyl)hydrazinylidene]-2-phenyl-butanoate is C17H16N4O6.
What is the molecular weight of Methyl 4-[(2,4-dinitrophenyl)hydrazinylidene]-2-phenyl-butanoate?
The molecular weight of Methyl 4-[(2,4-dinitrophenyl)hydrazinylidene]-2-phenyl-butanoate is 372.11 g/mol.
Where can I buy Methyl 4-[(2,4-dinitrophenyl)hydrazinylidene]-2-phenyl-butanoate?
You can request a quote for Methyl 4-[(2,4-dinitrophenyl)hydrazinylidene]-2-phenyl-butanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-[(2,4-dinitrophenyl)hydrazinylidene]-2-phenyl-butanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-[(2,4-dinitrophenyl)hydrazinylidene]-2-phenyl-butanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.