3-(3-Chlorophenyl)-1H-pyrazole-4-carboxaldehyde
TL;DR: 3-(3-Chlorophenyl)-1H-pyrazole-4-carboxaldehyde (CAS 681260-24-2) is a chemical compound with molecular formula C10H7ClN2O and molecular weight 206.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(3-chlorophenyl)-1H-pyrazole-4-carbaldehyde
Also Known As: 3-(3-chlorophenyl)-1h-pyrazole-4-carbaldehyde, 5-(3-chlorophenyl)-1H-pyrazole-4-carbaldehyde, 3-(3-Chloro-phenyl)-1H-pyrazole-4-carbaldehyde, 3-(3-Chlorophenyl)-1H-pyrazole-4-carboxaldehyde, 1H-pyrazole-4-carboxaldehyde, 3-(3-chlorophenyl)-
| Molecular Formula | C10H7ClN2O |
|---|---|
| Molecular Weight | 206.02 g/mol |
| LogP | 2.5426 |
| Topological Polar Surface Area | 45.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 206.02469 |
| Heavy Atoms | 14 |
| Complexity | 464.65048 |
Chemical Identifiers
| CAS Number | 681260-24-2 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Cl)C2=C(C=NN2)C=O |
Product Overview
3-(3-Chlorophenyl)-1H-pyrazole-4-carboxaldehyde (CAS 681260-24-2), with molecular formula C10H7ClN2O and molecular weight 206.02 g/mol. IUPAC: 5-(3-chlorophenyl)-1H-pyrazole-4-carbaldehyde.
Chemical Property Profile of 3-(3-Chlorophenyl)-1H-pyrazole-4-carboxaldehyde
Property Insights of 3-(3-Chlorophenyl)-1H-pyrazole-4-carboxaldehyde
The XLogP value of 2.5426 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(3-Chlorophenyl)-1H-pyrazole-4-carboxaldehyde. With a topological polar surface area (TPSA) of 45.75 Ų, 3-(3-Chlorophenyl)-1H-pyrazole-4-carboxaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(3-Chlorophenyl)-1H-pyrazole-4-carboxaldehyde has 1 hydrogen bond donor(s) and 2 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-(3-Chlorophenyl)-1H-pyrazole-4-carboxaldehyde?
The CAS number of 3-(3-Chlorophenyl)-1H-pyrazole-4-carboxaldehyde is 681260-24-2.
What is the molecular formula of 3-(3-Chlorophenyl)-1H-pyrazole-4-carboxaldehyde?
The molecular formula of 3-(3-Chlorophenyl)-1H-pyrazole-4-carboxaldehyde is C10H7ClN2O.
What is the molecular weight of 3-(3-Chlorophenyl)-1H-pyrazole-4-carboxaldehyde?
The molecular weight of 3-(3-Chlorophenyl)-1H-pyrazole-4-carboxaldehyde is 206.02 g/mol.
Where can I buy 3-(3-Chlorophenyl)-1H-pyrazole-4-carboxaldehyde?
You can request a quote for 3-(3-Chlorophenyl)-1H-pyrazole-4-carboxaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3-Chlorophenyl)-1H-pyrazole-4-carboxaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 3-(3-Chlorophenyl)-1H-pyrazole-4-carboxaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.