Methyl isopropyl ketone-dnph
TL;DR: Methyl isopropyl ketone-dnph (CAS 3077-97-2) is a chemical compound with molecular formula C11H14N4O4 and molecular weight 266.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-methylbutan-2-ylideneamino)-2,4-dinitroaniline
Also Known As: Methyl isopropyl ketone-dnph, Methyl isopropyl ketone DNPH, 3-Methyl-2-butanone 2,4-dinitrophenylhydrazone, 2-Butanone, 3-methyl-, (2,4-dinitrophenyl)hydrazone, methyl isopropyl ketone 2,4-dinitrophenylhydrazone
| Molecular Formula | C11H14N4O4 |
|---|---|
| Molecular Weight | 266.10 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 116.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 266.1015 |
| Heavy Atoms | 19 |
| Complexity | 372.0 |
Chemical Identifiers
| CAS Number | 3077-97-2 |
|---|---|
| SMILES | CC(C)C(=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])C |
| InChIKey | WXKQSBKURZFLTH-UHFFFAOYSA-N |
Product Overview
Methyl isopropyl ketone-dnph (CAS 3077-97-2), with molecular formula C11H14N4O4 and molecular weight 266.10 g/mol. IUPAC: N-(3-methylbutan-2-ylideneamino)-2,4-dinitroaniline.
Chemical Property Profile of Methyl isopropyl ketone-dnph
Property Insights of Methyl isopropyl ketone-dnph
The XLogP value of 4.1 indicates that Methyl isopropyl ketone-dnph is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl isopropyl ketone-dnph. Following Lipinski's Rule of Five, Methyl isopropyl ketone-dnph has 1 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 Methyl isopropyl ketone-dnph?
The CAS number of Methyl isopropyl ketone-dnph is 3077-97-2.
What is the molecular formula of Methyl isopropyl ketone-dnph?
The molecular formula of Methyl isopropyl ketone-dnph is C11H14N4O4.
What is the molecular weight of Methyl isopropyl ketone-dnph?
The molecular weight of Methyl isopropyl ketone-dnph is 266.10 g/mol.
Where can I buy Methyl isopropyl ketone-dnph?
You can request a quote for Methyl isopropyl ketone-dnph directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl isopropyl ketone-dnph?
Yes, KEHONG BIO provides custom synthesis services for Methyl isopropyl ketone-dnph and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.