![5-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-2-furaldehyde structure](/static/products/5128/512809-42-6.webp)
5-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-2-furaldehyde
TL;DR: 5-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-2-furaldehyde (CAS 512809-42-6) is a chemical compound with molecular formula C9H6ClN3O4 and molecular weight 255.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(4-chloro-3-nitropyrazol-1-yl)methyl]furan-2-carbaldehyde
Also Known As: 5-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-2-furaldehyde, 5-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]furan-2-carbaldehyde, 5-[(4-chloro-3-nitropyrazol-1-yl)methyl]furan-2-carbaldehyde, 5-(4-Chloro-3-nitro-pyrazol-1-ylmethyl)-furan-2-carbaldehyde, 5-({4-chloro-3-nitro-1H-pyrazol-1-yl}methyl)-2-furaldehyde
| Molecular Formula | C9H6ClN3O4 |
|---|---|
| Molecular Weight | 255.00 g/mol |
| LogP | 1.8985 |
| Topological Polar Surface Area | 91.17 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 255.00468 |
| Heavy Atoms | 17 |
| Complexity | 574.558 |
Chemical Identifiers
| CAS Number | 512809-42-6 |
|---|---|
| SMILES | C1=C(OC(=C1)C=O)CN2C=C(C(=N2)[N+](=O)[O-])Cl |
Product Overview
5-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-2-furaldehyde (CAS 512809-42-6), with molecular formula C9H6ClN3O4 and molecular weight 255.00 g/mol. IUPAC: 5-[(4-chloro-3-nitropyrazol-1-yl)methyl]furan-2-carbaldehyde.
Chemical Property Profile of 5-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-2-furaldehyde
Property Insights of 5-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-2-furaldehyde
The XLogP value of 1.8985 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-2-furaldehyde. The TPSA of 91.17 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-2-furaldehyde. Following Lipinski's Rule of Five, 5-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-2-furaldehyde has 0 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 5-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-2-furaldehyde?
The CAS number of 5-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-2-furaldehyde is 512809-42-6.
What is the molecular formula of 5-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-2-furaldehyde?
The molecular formula of 5-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-2-furaldehyde is C9H6ClN3O4.
What is the molecular weight of 5-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-2-furaldehyde?
The molecular weight of 5-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-2-furaldehyde is 255.00 g/mol.
Where can I buy 5-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-2-furaldehyde?
You can request a quote for 5-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-2-furaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-2-furaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 5-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-2-furaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.