3-Hydroxy-2-(4-nitrophenyl)prop-2-enal
TL;DR: 3-Hydroxy-2-(4-nitrophenyl)prop-2-enal (CAS 18915-53-2) is a chemical compound with molecular formula C9H7NO4 and molecular weight 193.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-hydroxy-2-(4-nitrophenyl)prop-2-enal
Also Known As: 2-(4-Nitrophenyl)-3-hydroxypropenal, 3-hydroxy-2-(4-nitrophenyl)prop-2-enal, 3-Hydroxy-2-(4-nitrophenyl)acrylaldehyde, (2Z)-3-Hydroxy-2-(4-nitrophenyl)acrylaldehyde, (Z)-3-Hydroxy-2-(4-nitro-phenyl)-propenal
| Molecular Formula | C9H7NO4 |
|---|---|
| Molecular Weight | 193.04 g/mol |
| LogP | 1.6926 |
| Topological Polar Surface Area | 80.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 193.0375 |
| Heavy Atoms | 14 |
| Complexity | 380.30334 |
Chemical Identifiers
| CAS Number | 18915-53-2 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=CO)C=O)[N+](=O)[O-] |
Product Overview
3-Hydroxy-2-(4-nitrophenyl)prop-2-enal (CAS 18915-53-2), with molecular formula C9H7NO4 and molecular weight 193.04 g/mol. IUPAC: 3-hydroxy-2-(4-nitrophenyl)prop-2-enal.
Chemical Property Profile of 3-Hydroxy-2-(4-nitrophenyl)prop-2-enal
Property Insights of 3-Hydroxy-2-(4-nitrophenyl)prop-2-enal
The XLogP value of 1.6926 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Hydroxy-2-(4-nitrophenyl)prop-2-enal. The TPSA of 80.44 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Hydroxy-2-(4-nitrophenyl)prop-2-enal. Following Lipinski's Rule of Five, 3-Hydroxy-2-(4-nitrophenyl)prop-2-enal has 1 hydrogen bond donor(s) and 4 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-Hydroxy-2-(4-nitrophenyl)prop-2-enal?
The CAS number of 3-Hydroxy-2-(4-nitrophenyl)prop-2-enal is 18915-53-2.
What is the molecular formula of 3-Hydroxy-2-(4-nitrophenyl)prop-2-enal?
The molecular formula of 3-Hydroxy-2-(4-nitrophenyl)prop-2-enal is C9H7NO4.
What is the molecular weight of 3-Hydroxy-2-(4-nitrophenyl)prop-2-enal?
The molecular weight of 3-Hydroxy-2-(4-nitrophenyl)prop-2-enal is 193.04 g/mol.
Where can I buy 3-Hydroxy-2-(4-nitrophenyl)prop-2-enal?
You can request a quote for 3-Hydroxy-2-(4-nitrophenyl)prop-2-enal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Hydroxy-2-(4-nitrophenyl)prop-2-enal?
Yes, KEHONG BIO provides custom synthesis services for 3-Hydroxy-2-(4-nitrophenyl)prop-2-enal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.