![3-[[(2,4-Dinitrophenyl)amino]carbamoyl]prop-2-enoic acid structure](/static/products/5435/5435-34-7.webp)
3-[[(2,4-Dinitrophenyl)amino]carbamoyl]prop-2-enoic acid
TL;DR: 3-[[(2,4-Dinitrophenyl)amino]carbamoyl]prop-2-enoic acid (CAS 5435-34-7) is a chemical compound with molecular formula C10H8N4O7 and molecular weight 296.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-(2,4-dinitrophenyl)hydrazinyl]-4-oxobut-2-enoic acid
Also Known As: 3-[[(2,4-dinitrophenyl)amino]carbamoyl]prop-2-enoic acid, 4-[2-(2,4-dinitrophenyl)hydrazinyl]-4-oxobut-2-enoic acid, 3-(N'-(2,4-DINITRO-PHENYL)-HYDRAZINOCARBONYL)-ACRYLIC ACID
| Molecular Formula | C10H8N4O7 |
|---|---|
| Molecular Weight | 296.04 g/mol |
| LogP | 0.5869 |
| Topological Polar Surface Area | 164.71 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 296.0393 |
| Heavy Atoms | 21 |
| Complexity | 640.2934 |
Chemical Identifiers
| CAS Number | 5435-34-7 |
|---|---|
| SMILES | C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])NNC(=O)C=CC(=O)O |
Product Overview
3-[[(2,4-Dinitrophenyl)amino]carbamoyl]prop-2-enoic acid (CAS 5435-34-7), with molecular formula C10H8N4O7 and molecular weight 296.04 g/mol. IUPAC: 4-[2-(2,4-dinitrophenyl)hydrazinyl]-4-oxobut-2-enoic acid.
Chemical Property Profile of 3-[[(2,4-Dinitrophenyl)amino]carbamoyl]prop-2-enoic acid
Property Insights of 3-[[(2,4-Dinitrophenyl)amino]carbamoyl]prop-2-enoic acid
The XLogP value of 0.5869 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[[(2,4-Dinitrophenyl)amino]carbamoyl]prop-2-enoic acid. The TPSA of 164.71 Ų indicates high polarity, suggesting 3-[[(2,4-Dinitrophenyl)amino]carbamoyl]prop-2-enoic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3-[[(2,4-Dinitrophenyl)amino]carbamoyl]prop-2-enoic acid has 3 hydrogen bond donor(s) and 7 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)amino]carbamoyl]prop-2-enoic acid?
The CAS number of 3-[[(2,4-Dinitrophenyl)amino]carbamoyl]prop-2-enoic acid is 5435-34-7.
What is the molecular formula of 3-[[(2,4-Dinitrophenyl)amino]carbamoyl]prop-2-enoic acid?
The molecular formula of 3-[[(2,4-Dinitrophenyl)amino]carbamoyl]prop-2-enoic acid is C10H8N4O7.
What is the molecular weight of 3-[[(2,4-Dinitrophenyl)amino]carbamoyl]prop-2-enoic acid?
The molecular weight of 3-[[(2,4-Dinitrophenyl)amino]carbamoyl]prop-2-enoic acid is 296.04 g/mol.
Where can I buy 3-[[(2,4-Dinitrophenyl)amino]carbamoyl]prop-2-enoic acid?
You can request a quote for 3-[[(2,4-Dinitrophenyl)amino]carbamoyl]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)amino]carbamoyl]prop-2-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[[(2,4-Dinitrophenyl)amino]carbamoyl]prop-2-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.