(4-Chloro-3-methyl-pyrazol-1-yl)-acetyl chloride
TL;DR: (4-Chloro-3-methyl-pyrazol-1-yl)-acetyl chloride (CAS 1002534-97-5) is a chemical compound with molecular formula C6H6Cl2N2O and molecular weight 191.98572 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-chloro-3-methylpyrazol-1-yl)acetyl chloride
Also Known As: (4-Chloro-3-methyl-pyrazol-1-yl)-acetyl chloride, 2-(4-Chloro-3-methyl-1H-pyrazol-1-yl)acetyl chloride, 2-(4-chloro-3-methylpyrazol-1-yl)acetyl chloride, 2-(4-chloro-3-methylpyrazolyl)acetyl chloride, (4-Chloro-3-methyl-pyrazol-1-yl)-acetylchloride
Technical Specifications
| Molecular Formula | C6H6Cl2N2O |
| Molecular Weight | 191.98572 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 34.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 191.98572 Da |
| Heavy Atoms | 11 |
| Complexity | 165.0 |
| SMILES | CC1=NN(C=C1Cl)CC(=O)Cl |
| InChIKey | MQUHNWGVANLSMS-UHFFFAOYSA-N |
Chemical Property Profile of (4-Chloro-3-methyl-pyrazol-1-yl)-acetyl chloride
Property Insights of (4-Chloro-3-methyl-pyrazol-1-yl)-acetyl chloride
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-Chloro-3-methyl-pyrazol-1-yl)-acetyl chloride. With a topological polar surface area (TPSA) of 34.9 Ų, (4-Chloro-3-methyl-pyrazol-1-yl)-acetyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Chloro-3-methyl-pyrazol-1-yl)-acetyl chloride 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
What is the CAS number of (4-Chloro-3-methyl-pyrazol-1-yl)-acetyl chloride?
The CAS number of (4-Chloro-3-methyl-pyrazol-1-yl)-acetyl chloride is 1002534-97-5.
What is the molecular formula of (4-Chloro-3-methyl-pyrazol-1-yl)-acetyl chloride?
The molecular formula of (4-Chloro-3-methyl-pyrazol-1-yl)-acetyl chloride is C6H6Cl2N2O.
What is the molecular weight of (4-Chloro-3-methyl-pyrazol-1-yl)-acetyl chloride?
The molecular weight of (4-Chloro-3-methyl-pyrazol-1-yl)-acetyl chloride is 191.98572 g/mol.
Where can I buy (4-Chloro-3-methyl-pyrazol-1-yl)-acetyl chloride?
You can request a quote for (4-Chloro-3-methyl-pyrazol-1-yl)-acetyl chloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (4-Chloro-3-methyl-pyrazol-1-yl)-acetyl chloride?
Yes, CoreyChem provides custom synthesis services for (4-Chloro-3-methyl-pyrazol-1-yl)-acetyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.