3-Methoxy-4-((4-nitro-1H-pyrazol-1-yl)methoxy)benzaldehyde
TL;DR: 3-Methoxy-4-((4-nitro-1H-pyrazol-1-yl)methoxy)benzaldehyde (CAS 1005634-50-3) is a chemical compound with molecular formula C12H11N3O5 and molecular weight 277.0699 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-methoxy-4-[(4-nitropyrazol-1-yl)methoxy]benzaldehyde
Also Known As: 3-Methoxy-4-((4-nitro-1H-pyrazol-1-yl)methoxy)benzaldehyde, 3-methoxy-4-[(4-nitropyrazol-1-yl)methoxy]benzaldehyde, 3-methoxy-4-[(4-nitropyrazolyl)methoxy]benzaldehyde, 3-methoxy-4-[(4-nitro-1H-pyrazol-1-yl)methoxy]benzaldehyde
Technical Specifications
| Molecular Formula | C12H11N3O5 |
| Molecular Weight | 277.0699 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 99.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 277.0699 Da |
| Heavy Atoms | 20 |
| Complexity | 348.0 |
| SMILES | COC1=C(C=CC(=C1)C=O)OCN2C=C(C=N2)[N+](=O)[O-] |
| InChIKey | COMKAZLNPHLDEX-UHFFFAOYSA-N |
Chemical Property Profile of 3-Methoxy-4-((4-nitro-1H-pyrazol-1-yl)methoxy)benzaldehyde
Property Insights of 3-Methoxy-4-((4-nitro-1H-pyrazol-1-yl)methoxy)benzaldehyde
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methoxy-4-((4-nitro-1H-pyrazol-1-yl)methoxy)benzaldehyde. The TPSA of 99.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Methoxy-4-((4-nitro-1H-pyrazol-1-yl)methoxy)benzaldehyde. Following Lipinski's Rule of Five, 3-Methoxy-4-((4-nitro-1H-pyrazol-1-yl)methoxy)benzaldehyde has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-Methoxy-4-((4-nitro-1H-pyrazol-1-yl)methoxy)benzaldehyde?
The CAS number of 3-Methoxy-4-((4-nitro-1H-pyrazol-1-yl)methoxy)benzaldehyde is 1005634-50-3.
What is the molecular formula of 3-Methoxy-4-((4-nitro-1H-pyrazol-1-yl)methoxy)benzaldehyde?
The molecular formula of 3-Methoxy-4-((4-nitro-1H-pyrazol-1-yl)methoxy)benzaldehyde is C12H11N3O5.
What is the molecular weight of 3-Methoxy-4-((4-nitro-1H-pyrazol-1-yl)methoxy)benzaldehyde?
The molecular weight of 3-Methoxy-4-((4-nitro-1H-pyrazol-1-yl)methoxy)benzaldehyde is 277.0699 g/mol.
Where can I buy 3-Methoxy-4-((4-nitro-1H-pyrazol-1-yl)methoxy)benzaldehyde?
You can request a quote for 3-Methoxy-4-((4-nitro-1H-pyrazol-1-yl)methoxy)benzaldehyde directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Methoxy-4-((4-nitro-1H-pyrazol-1-yl)methoxy)benzaldehyde?
Yes, CoreyChem provides custom synthesis services for 3-Methoxy-4-((4-nitro-1H-pyrazol-1-yl)methoxy)benzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.