4-chloro-1-methyl-1H-pyrazole-3-carbaldehyde
TL;DR: 4-chloro-1-methyl-1H-pyrazole-3-carbaldehyde (CAS 175204-81-6) is a chemical compound with molecular formula C5H5ClN2O and molecular weight 144.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-1-methylpyrazole-3-carbaldehyde
Also Known As: 4-chloro-1-methyl-1H-pyrazole-3-carbaldehyde, 4-chloro-1-methylpyrazole-3-carbaldehyde, 4-Chloro-1-methylpyrazole-3-carboxaldehyde, 4-chloro-1-methyl-1h-pyrazole-3-carboxaldehyde, 1H-Pyrazole-3-carboxaldehyde, 4-chloro-1-methyl-
| Molecular Formula | C5H5ClN2O |
|---|---|
| Molecular Weight | 144.01 g/mol |
| LogP | 0.886 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 144.00903 |
| Heavy Atoms | 9 |
| Complexity | 230.86191 |
Chemical Identifiers
| CAS Number | 175204-81-6 |
|---|---|
| SMILES | CN1C=C(C(=N1)C=O)Cl |
Product Overview
4-chloro-1-methyl-1H-pyrazole-3-carbaldehyde (CAS 175204-81-6), with molecular formula C5H5ClN2O and molecular weight 144.01 g/mol. IUPAC: 4-chloro-1-methylpyrazole-3-carbaldehyde.
Chemical Property Profile of 4-chloro-1-methyl-1H-pyrazole-3-carbaldehyde
Property Insights of 4-chloro-1-methyl-1H-pyrazole-3-carbaldehyde
The XLogP value of 0.886 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-chloro-1-methyl-1H-pyrazole-3-carbaldehyde. With a topological polar surface area (TPSA) of 34.89 Ų, 4-chloro-1-methyl-1H-pyrazole-3-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-chloro-1-methyl-1H-pyrazole-3-carbaldehyde has 0 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 4-chloro-1-methyl-1H-pyrazole-3-carbaldehyde?
The CAS number of 4-chloro-1-methyl-1H-pyrazole-3-carbaldehyde is 175204-81-6.
What is the molecular formula of 4-chloro-1-methyl-1H-pyrazole-3-carbaldehyde?
The molecular formula of 4-chloro-1-methyl-1H-pyrazole-3-carbaldehyde is C5H5ClN2O.
What is the molecular weight of 4-chloro-1-methyl-1H-pyrazole-3-carbaldehyde?
The molecular weight of 4-chloro-1-methyl-1H-pyrazole-3-carbaldehyde is 144.01 g/mol.
Where can I buy 4-chloro-1-methyl-1H-pyrazole-3-carbaldehyde?
You can request a quote for 4-chloro-1-methyl-1H-pyrazole-3-carbaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-chloro-1-methyl-1H-pyrazole-3-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 4-chloro-1-methyl-1H-pyrazole-3-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.