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 277.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
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
| Molecular Formula | C12H11N3O5 |
|---|---|
| Molecular Weight | 277.07 g/mol |
| LogP | 1.6489 |
| Topological Polar Surface Area | 96.49 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 277.0699 |
| Heavy Atoms | 20 |
| Complexity | 637.7731 |
Chemical Identifiers
| CAS Number | 1005634-50-3 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)C=O)OCN2C=C(C=N2)[N+](=O)[O-] |
Product Overview
3-Methoxy-4-((4-nitro-1H-pyrazol-1-yl)methoxy)benzaldehyde (CAS 1005634-50-3), with molecular formula C12H11N3O5 and molecular weight 277.07 g/mol. IUPAC: 3-methoxy-4-[(4-nitropyrazol-1-yl)methoxy]benzaldehyde.
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 1.6489 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methoxy-4-((4-nitro-1H-pyrazol-1-yl)methoxy)benzaldehyde. The TPSA of 96.49 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
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 277.07 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 KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methoxy-4-((4-nitro-1H-pyrazol-1-yl)methoxy)benzaldehyde?
Yes, KEHONG BIO 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.