4-chloro-5-methyl-1H-pyrazole
TL;DR: 4-chloro-5-methyl-1H-pyrazole (CAS 1092682-87-5) is a chemical compound with molecular formula C4H5ClN2 and molecular weight 116.01413 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-chloro-5-methyl-1H-pyrazole
Also Known As: 4-chloro-3-methyl-1H-pyrazole, 4-chloro-5-methyl-1H-pyrazole, 4-Chloro-3-methylpyrazole, 3-Methyl-4-chloropyrazole, 1H-Pyrazole, 4-chloro-3-methyl-
Application Areas
Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C4H5ClN2 |
| Molecular Weight | 116.01413 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 28.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 116.01413 Da |
| Heavy Atoms | 7 |
| Complexity | 66.0 |
| SMILES | CC1=C(C=NN1)Cl |
| InChIKey | LCDKUXJKMAFCTI-UHFFFAOYSA-N |
Chemical Property Profile of 4-chloro-5-methyl-1H-pyrazole
Property Insights of 4-chloro-5-methyl-1H-pyrazole
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-chloro-5-methyl-1H-pyrazole. With a topological polar surface area (TPSA) of 28.7 Ų, 4-chloro-5-methyl-1H-pyrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-chloro-5-methyl-1H-pyrazole has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-chloro-5-methyl-1H-pyrazole?
The CAS number of 4-chloro-5-methyl-1H-pyrazole is 1092682-87-5.
What is the molecular formula of 4-chloro-5-methyl-1H-pyrazole?
The molecular formula of 4-chloro-5-methyl-1H-pyrazole is C4H5ClN2.
What is the molecular weight of 4-chloro-5-methyl-1H-pyrazole?
The molecular weight of 4-chloro-5-methyl-1H-pyrazole is 116.01413 g/mol.
Where can I buy 4-chloro-5-methyl-1H-pyrazole?
You can request a quote for 4-chloro-5-methyl-1H-pyrazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-chloro-5-methyl-1H-pyrazole?
Yes, CoreyChem provides custom synthesis services for 4-chloro-5-methyl-1H-pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.