4-Ethoxy-3-nitrobenzaldehyde
TL;DR: 4-Ethoxy-3-nitrobenzaldehyde (CAS 132390-61-5) is a chemical compound with molecular formula C9H9NO4 and molecular weight 195.05316 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-ethoxy-3-nitrobenzaldehyde
Also Known As: 4-Ethoxy-3-nitrobenzaldehyde, 4-ETHOXY-3-NITROBENZALDEHYDE 97, 4-ethoxy-3-nitro-benzaldehyde, 4-Ethoxy-3-nitrobenzaldehyde, 97%, 4-ETHOXY-3-NITROBENZALDEHYDE97
Technical Specifications
| Molecular Formula | C9H9NO4 |
| Molecular Weight | 195.05316 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 72.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 195.05316 Da |
| Heavy Atoms | 14 |
| Complexity | 213.0 |
| SMILES | CCOC1=C(C=C(C=C1)C=O)[N+](=O)[O-] |
| InChIKey | RPJKVMCCDKVUJN-UHFFFAOYSA-N |
Chemical Property Profile of 4-Ethoxy-3-nitrobenzaldehyde
Property Insights of 4-Ethoxy-3-nitrobenzaldehyde
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Ethoxy-3-nitrobenzaldehyde. The TPSA of 72.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Ethoxy-3-nitrobenzaldehyde. Following Lipinski's Rule of Five, 4-Ethoxy-3-nitrobenzaldehyde has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-Ethoxy-3-nitrobenzaldehyde?
The CAS number of 4-Ethoxy-3-nitrobenzaldehyde is 132390-61-5.
What is the molecular formula of 4-Ethoxy-3-nitrobenzaldehyde?
The molecular formula of 4-Ethoxy-3-nitrobenzaldehyde is C9H9NO4.
What is the molecular weight of 4-Ethoxy-3-nitrobenzaldehyde?
The molecular weight of 4-Ethoxy-3-nitrobenzaldehyde is 195.05316 g/mol.
Where can I buy 4-Ethoxy-3-nitrobenzaldehyde?
You can request a quote for 4-Ethoxy-3-nitrobenzaldehyde directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Ethoxy-3-nitrobenzaldehyde?
Yes, CoreyChem provides custom synthesis services for 4-Ethoxy-3-nitrobenzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.