![3-(4-Nitrophenyl)-2-[(4-nitrophenyl)methyl]propanoic acid structure](/static/products/1610/1610-61-3.webp)
3-(4-Nitrophenyl)-2-[(4-nitrophenyl)methyl]propanoic acid
TL;DR: 3-(4-Nitrophenyl)-2-[(4-nitrophenyl)methyl]propanoic acid (CAS 1610-61-3) is a chemical compound with molecular formula C16H14N2O6 and molecular weight 330.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-nitrophenyl)-2-[(4-nitrophenyl)methyl]propanoic acid
Also Known As: a-(4-Nitrobenzyl)-4-nitrobenzenepropanoic acid, 3-(4-nitrophenyl)-2-[(4-nitrophenyl)methyl]propanoic acid, beta, beta'-Bis-(p-nitrophenyl)-isobutyric acid, 2-(4-nitrobenzyl)-3-(4-nitrophenyl)propanoic acid
| Molecular Formula | C16H14N2O6 |
|---|---|
| Molecular Weight | 330.09 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 129.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 330.08517 |
| Heavy Atoms | 24 |
| Complexity | 420.0 |
Chemical Identifiers
| CAS Number | 1610-61-3 |
|---|---|
| SMILES | C1=CC(=CC=C1CC(CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)O)[N+](=O)[O-] |
| InChIKey | DQOFLUAWSNDDKP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(4-Nitrophenyl)-2-[(4-nitrophenyl)methyl]propanoic acid (CAS 1610-61-3), with molecular formula C16H14N2O6 and molecular weight 330.09 g/mol. IUPAC: 3-(4-nitrophenyl)-2-[(4-nitrophenyl)methyl]propanoic acid.
Chemical Property Profile of 3-(4-Nitrophenyl)-2-[(4-nitrophenyl)methyl]propanoic acid
Property Insights of 3-(4-Nitrophenyl)-2-[(4-nitrophenyl)methyl]propanoic acid
The XLogP value of 3.3 indicates that 3-(4-Nitrophenyl)-2-[(4-nitrophenyl)methyl]propanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 129.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-Nitrophenyl)-2-[(4-nitrophenyl)methyl]propanoic acid. Following Lipinski's Rule of Five, 3-(4-Nitrophenyl)-2-[(4-nitrophenyl)methyl]propanoic acid 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 3-(4-Nitrophenyl)-2-[(4-nitrophenyl)methyl]propanoic acid?
The CAS number of 3-(4-Nitrophenyl)-2-[(4-nitrophenyl)methyl]propanoic acid is 1610-61-3.
What is the molecular formula of 3-(4-Nitrophenyl)-2-[(4-nitrophenyl)methyl]propanoic acid?
The molecular formula of 3-(4-Nitrophenyl)-2-[(4-nitrophenyl)methyl]propanoic acid is C16H14N2O6.
What is the molecular weight of 3-(4-Nitrophenyl)-2-[(4-nitrophenyl)methyl]propanoic acid?
The molecular weight of 3-(4-Nitrophenyl)-2-[(4-nitrophenyl)methyl]propanoic acid is 330.09 g/mol.
Where can I buy 3-(4-Nitrophenyl)-2-[(4-nitrophenyl)methyl]propanoic acid?
You can request a quote for 3-(4-Nitrophenyl)-2-[(4-nitrophenyl)methyl]propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Nitrophenyl)-2-[(4-nitrophenyl)methyl]propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Nitrophenyl)-2-[(4-nitrophenyl)methyl]propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.