3-(2,4-dinitrophenyl)prop-2-enoic Acid
TL;DR: 3-(2,4-dinitrophenyl)prop-2-enoic Acid (CAS 85818-66-2) is a chemical compound with molecular formula C9H6N2O6 and molecular weight 238.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,4-dinitrophenyl)prop-2-enoic acid
Also Known As: 2,4-Dinitrocinnamic acid, 2,4-dinitro-cinnamic acid, 3-(2,4-dinitrophenyl)prop-2-enoic Acid, RefChem:273431
| Molecular Formula | C9H6N2O6 |
|---|---|
| Molecular Weight | 238.02 g/mol |
| LogP | 1.6008 |
| Topological Polar Surface Area | 123.58 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 238.02258 |
| Heavy Atoms | 17 |
| Complexity | 522.2174 |
Chemical Identifiers
| CAS Number | 85818-66-2 |
|---|---|
| SMILES | C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C=CC(=O)O |
Product Overview
3-(2,4-dinitrophenyl)prop-2-enoic Acid (CAS 85818-66-2), with molecular formula C9H6N2O6 and molecular weight 238.02 g/mol. IUPAC: 3-(2,4-dinitrophenyl)prop-2-enoic acid.
Chemical Property Profile of 3-(2,4-dinitrophenyl)prop-2-enoic Acid
Property Insights of 3-(2,4-dinitrophenyl)prop-2-enoic Acid
The XLogP value of 1.6008 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2,4-dinitrophenyl)prop-2-enoic Acid. The TPSA of 123.58 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2,4-dinitrophenyl)prop-2-enoic Acid. Following Lipinski's Rule of Five, 3-(2,4-dinitrophenyl)prop-2-enoic Acid has 1 hydrogen bond donor(s) and 5 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-(2,4-dinitrophenyl)prop-2-enoic Acid?
The CAS number of 3-(2,4-dinitrophenyl)prop-2-enoic Acid is 85818-66-2.
What is the molecular formula of 3-(2,4-dinitrophenyl)prop-2-enoic Acid?
The molecular formula of 3-(2,4-dinitrophenyl)prop-2-enoic Acid is C9H6N2O6.
What is the molecular weight of 3-(2,4-dinitrophenyl)prop-2-enoic Acid?
The molecular weight of 3-(2,4-dinitrophenyl)prop-2-enoic Acid is 238.02 g/mol.
Where can I buy 3-(2,4-dinitrophenyl)prop-2-enoic Acid?
You can request a quote for 3-(2,4-dinitrophenyl)prop-2-enoic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2,4-dinitrophenyl)prop-2-enoic Acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(2,4-dinitrophenyl)prop-2-enoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.