5-Chloro-1,4-dimethyl-1H-pyrazole
TL;DR: 5-Chloro-1,4-dimethyl-1H-pyrazole (CAS 127842-11-9) is a chemical compound with molecular formula C5H7ClN2 and molecular weight 130.02977 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-chloro-1,4-dimethylpyrazole
Also Known As: 5-Chloro-1,4-dimethyl-1H-pyrazole, 5-chloro-1,4-dimethylpyrazole, 5-chloro-1,4-dimethyl-pyrazole, 1,4-dimethyl-5-chloro-1H-pyrazole, J1.632.004H
Technical Specifications
| Molecular Formula | C5H7ClN2 |
| Molecular Weight | 130.02977 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 17.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 130.02977 Da |
| Heavy Atoms | 8 |
| Complexity | 86.0 |
| SMILES | CC1=C(N(N=C1)C)Cl |
| InChIKey | WYLLIHCCRZGVSG-UHFFFAOYSA-N |
Chemical Property Profile of 5-Chloro-1,4-dimethyl-1H-pyrazole
Property Insights of 5-Chloro-1,4-dimethyl-1H-pyrazole
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Chloro-1,4-dimethyl-1H-pyrazole. With a topological polar surface area (TPSA) of 17.8 Ų, 5-Chloro-1,4-dimethyl-1H-pyrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Chloro-1,4-dimethyl-1H-pyrazole has 0 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 5-Chloro-1,4-dimethyl-1H-pyrazole?
The CAS number of 5-Chloro-1,4-dimethyl-1H-pyrazole is 127842-11-9.
What is the molecular formula of 5-Chloro-1,4-dimethyl-1H-pyrazole?
The molecular formula of 5-Chloro-1,4-dimethyl-1H-pyrazole is C5H7ClN2.
What is the molecular weight of 5-Chloro-1,4-dimethyl-1H-pyrazole?
The molecular weight of 5-Chloro-1,4-dimethyl-1H-pyrazole is 130.02977 g/mol.
Where can I buy 5-Chloro-1,4-dimethyl-1H-pyrazole?
You can request a quote for 5-Chloro-1,4-dimethyl-1H-pyrazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-Chloro-1,4-dimethyl-1H-pyrazole?
Yes, CoreyChem provides custom synthesis services for 5-Chloro-1,4-dimethyl-1H-pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.