![[2-Methyl-1-oxo-1-(4-phenylphenyl)propan-2-yl] 3,5-dinitrobenzoate structure](/static/products/7472/7472-40-4.webp)
[2-Methyl-1-oxo-1-(4-phenylphenyl)propan-2-yl] 3,5-dinitrobenzoate
TL;DR: [2-Methyl-1-oxo-1-(4-phenylphenyl)propan-2-yl] 3,5-dinitrobenzoate (CAS 7472-40-4) is a chemical compound with molecular formula C23H18N2O7 and molecular weight 434.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-methyl-1-oxo-1-(4-phenylphenyl)propan-2-yl] 3,5-dinitrobenzoate
Also Known As: [2-methyl-1-oxo-1-(4-phenylphenyl)propan-2-yl] 3,5-dinitrobenzoate|[2-methyl-1-oxo-1-(4-phenylphenyl)propan-2-yl] 3,5-dinitrobe|1-([1,1'-Biphenyl]-4-yl)-2-methyl-1-oxopropan-2-yl 3,5-dinitrobenzoate
| Molecular Formula | C23H18N2O7 |
|---|---|
| Molecular Weight | 434.11 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 135.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 434.1114 |
| Heavy Atoms | 32 |
| Complexity | 691.0 |
Chemical Identifiers
| CAS Number | 7472-40-4 |
|---|---|
| SMILES | CC(C)(C(=O)C1=CC=C(C=C1)C2=CC=CC=C2)OC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | VJMFVNDKJQUPDN-UHFFFAOYSA-N |
Product Overview
[2-Methyl-1-oxo-1-(4-phenylphenyl)propan-2-yl] 3,5-dinitrobenzoate (CAS 7472-40-4), with molecular formula C23H18N2O7 and molecular weight 434.11 g/mol. IUPAC: [2-methyl-1-oxo-1-(4-phenylphenyl)propan-2-yl] 3,5-dinitrobenzoate.
Chemical Property Profile of [2-Methyl-1-oxo-1-(4-phenylphenyl)propan-2-yl] 3,5-dinitrobenzoate
Property Insights of [2-Methyl-1-oxo-1-(4-phenylphenyl)propan-2-yl] 3,5-dinitrobenzoate
The XLogP value of 5.1 indicates that [2-Methyl-1-oxo-1-(4-phenylphenyl)propan-2-yl] 3,5-dinitrobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-Methyl-1-oxo-1-(4-phenylphenyl)propan-2-yl] 3,5-dinitrobenzoate. Following Lipinski's Rule of Five, [2-Methyl-1-oxo-1-(4-phenylphenyl)propan-2-yl] 3,5-dinitrobenzoate has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of [2-Methyl-1-oxo-1-(4-phenylphenyl)propan-2-yl] 3,5-dinitrobenzoate?
The CAS number of [2-Methyl-1-oxo-1-(4-phenylphenyl)propan-2-yl] 3,5-dinitrobenzoate is 7472-40-4.
What is the molecular formula of [2-Methyl-1-oxo-1-(4-phenylphenyl)propan-2-yl] 3,5-dinitrobenzoate?
The molecular formula of [2-Methyl-1-oxo-1-(4-phenylphenyl)propan-2-yl] 3,5-dinitrobenzoate is C23H18N2O7.
What is the molecular weight of [2-Methyl-1-oxo-1-(4-phenylphenyl)propan-2-yl] 3,5-dinitrobenzoate?
The molecular weight of [2-Methyl-1-oxo-1-(4-phenylphenyl)propan-2-yl] 3,5-dinitrobenzoate is 434.11 g/mol.
Where can I buy [2-Methyl-1-oxo-1-(4-phenylphenyl)propan-2-yl] 3,5-dinitrobenzoate?
You can request a quote for [2-Methyl-1-oxo-1-(4-phenylphenyl)propan-2-yl] 3,5-dinitrobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-Methyl-1-oxo-1-(4-phenylphenyl)propan-2-yl] 3,5-dinitrobenzoate?
Yes, KEHONG BIO provides custom synthesis services for [2-Methyl-1-oxo-1-(4-phenylphenyl)propan-2-yl] 3,5-dinitrobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.