2-(4-Hydroxycarbonyl-2-nitrophenyl)malondialdehyde
TL;DR: 2-(4-Hydroxycarbonyl-2-nitrophenyl)malondialdehyde (CAS 205985-96-2) is a chemical compound with molecular formula C10H7NO6 and molecular weight 237.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1,3-dioxopropan-2-yl)-3-nitrobenzoic acid
Also Known As: 4-(1,3-dioxopropan-2-yl)-3-nitrobenzoic acid, 2- MALONDIALDEHYDE,95, 2-(4-Hydroxycarbonyl-2-nitrophenyl)malondialdehyde, 2-(4-hydroxycarbonyl-2-nitrophenyl)-malondialdehyde, 6978AD
| Molecular Formula | C10H7NO6 |
|---|---|
| Molecular Weight | 237.03 g/mol |
| LogP | 0.7744 |
| Topological Polar Surface Area | 114.58 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 237.02734 |
| Heavy Atoms | 17 |
| Complexity | 487.56952 |
Chemical Identifiers
| CAS Number | 205985-96-2 |
|---|---|
| SMILES | C1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])C(C=O)C=O |
Product Overview
2-(4-Hydroxycarbonyl-2-nitrophenyl)malondialdehyde (CAS 205985-96-2), with molecular formula C10H7NO6 and molecular weight 237.03 g/mol. IUPAC: 4-(1,3-dioxopropan-2-yl)-3-nitrobenzoic acid.
Chemical Property Profile of 2-(4-Hydroxycarbonyl-2-nitrophenyl)malondialdehyde
Property Insights of 2-(4-Hydroxycarbonyl-2-nitrophenyl)malondialdehyde
The XLogP value of 0.7744 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Hydroxycarbonyl-2-nitrophenyl)malondialdehyde. The TPSA of 114.58 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Hydroxycarbonyl-2-nitrophenyl)malondialdehyde. Following Lipinski's Rule of Five, 2-(4-Hydroxycarbonyl-2-nitrophenyl)malondialdehyde 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 2-(4-Hydroxycarbonyl-2-nitrophenyl)malondialdehyde?
The CAS number of 2-(4-Hydroxycarbonyl-2-nitrophenyl)malondialdehyde is 205985-96-2.
What is the molecular formula of 2-(4-Hydroxycarbonyl-2-nitrophenyl)malondialdehyde?
The molecular formula of 2-(4-Hydroxycarbonyl-2-nitrophenyl)malondialdehyde is C10H7NO6.
What is the molecular weight of 2-(4-Hydroxycarbonyl-2-nitrophenyl)malondialdehyde?
The molecular weight of 2-(4-Hydroxycarbonyl-2-nitrophenyl)malondialdehyde is 237.03 g/mol.
Where can I buy 2-(4-Hydroxycarbonyl-2-nitrophenyl)malondialdehyde?
You can request a quote for 2-(4-Hydroxycarbonyl-2-nitrophenyl)malondialdehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Hydroxycarbonyl-2-nitrophenyl)malondialdehyde?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Hydroxycarbonyl-2-nitrophenyl)malondialdehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.