1H-Pyrazole, 4-chloro-
TL;DR: 1H-Pyrazole, 4-chloro- (CAS 15878-00-9) is a chemical compound with molecular formula C3H3ClN2 and molecular weight 101.998474 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-chloro-1H-pyrazole
Also Known As: 4-Chloropyrazole, 4-Chloro-1H-pyrazole, 1H-Pyrazole, 4-chloro-, 4-chloro pyrazole, 4 -chloropyrazole
Application Areas
Top 5 of 11 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C3H3ClN2 |
| Molecular Weight | 101.998474 g/mol |
| XLogP | 0.2 |
| Topological Polar Surface Area (TPSA) | 28.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 101.998474 Da |
| Heavy Atoms | 6 |
| Complexity | 48.0 |
| SMILES | C1=C(C=NN1)Cl |
| InChIKey | BADSZRMNXWLUKO-UHFFFAOYSA-N |
Chemical Property Profile of 1H-Pyrazole, 4-chloro-
Property Insights of 1H-Pyrazole, 4-chloro-
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Pyrazole, 4-chloro-. With a topological polar surface area (TPSA) of 28.7 Ų, 1H-Pyrazole, 4-chloro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Pyrazole, 4-chloro- 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 1H-Pyrazole, 4-chloro-?
The CAS number of 1H-Pyrazole, 4-chloro- is 15878-00-9.
What is the molecular formula of 1H-Pyrazole, 4-chloro-?
The molecular formula of 1H-Pyrazole, 4-chloro- is C3H3ClN2.
What is the molecular weight of 1H-Pyrazole, 4-chloro-?
The molecular weight of 1H-Pyrazole, 4-chloro- is 101.998474 g/mol.
Where can I buy 1H-Pyrazole, 4-chloro-?
You can request a quote for 1H-Pyrazole, 4-chloro- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1H-Pyrazole, 4-chloro-?
Yes, CoreyChem provides custom synthesis services for 1H-Pyrazole, 4-chloro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.