1-Ethyl-3-methyl-1H-pyrazole-5-carbonyl chloride
TL;DR: 1-Ethyl-3-methyl-1H-pyrazole-5-carbonyl chloride (CAS 128249-59-2) is a chemical compound with molecular formula C7H9ClN2O and molecular weight 172.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethyl-5-methylpyrazole-3-carbonyl chloride
Also Known As: 1-Ethyl-3-methyl-1H-pyrazole-5-carbonyl chloride, 2-ethyl-5-methylpyrazole-3-carbonyl chloride, 1-Ethyl-3-Methylpyrazole-5-Carbonyl Chloride, BUTTPARK 37\06-100, 1H-Pyrazole-5-carbonylchloride, 1-ethyl-3-methyl-
| Molecular Formula | C7H9ClN2O |
|---|---|
| Molecular Weight | 172.04 g/mol |
| LogP | 1.59042 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 172.04034 |
| Heavy Atoms | 11 |
| Complexity | 279.968 |
Chemical Identifiers
| CAS Number | 128249-59-2 |
|---|---|
| SMILES | CCN1C(=CC(=N1)C)C(=O)Cl |
Product Overview
1-Ethyl-3-methyl-1H-pyrazole-5-carbonyl chloride (CAS 128249-59-2), with molecular formula C7H9ClN2O and molecular weight 172.04 g/mol. IUPAC: 2-ethyl-5-methylpyrazole-3-carbonyl chloride.
Chemical Property Profile of 1-Ethyl-3-methyl-1H-pyrazole-5-carbonyl chloride
Property Insights of 1-Ethyl-3-methyl-1H-pyrazole-5-carbonyl chloride
The XLogP value of 1.59042 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Ethyl-3-methyl-1H-pyrazole-5-carbonyl chloride. With a topological polar surface area (TPSA) of 34.89 Ų, 1-Ethyl-3-methyl-1H-pyrazole-5-carbonyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Ethyl-3-methyl-1H-pyrazole-5-carbonyl 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
Frequently Asked Questions
What is the CAS number of 1-Ethyl-3-methyl-1H-pyrazole-5-carbonyl chloride?
The CAS number of 1-Ethyl-3-methyl-1H-pyrazole-5-carbonyl chloride is 128249-59-2.
What is the molecular formula of 1-Ethyl-3-methyl-1H-pyrazole-5-carbonyl chloride?
The molecular formula of 1-Ethyl-3-methyl-1H-pyrazole-5-carbonyl chloride is C7H9ClN2O.
What is the molecular weight of 1-Ethyl-3-methyl-1H-pyrazole-5-carbonyl chloride?
The molecular weight of 1-Ethyl-3-methyl-1H-pyrazole-5-carbonyl chloride is 172.04 g/mol.
Where can I buy 1-Ethyl-3-methyl-1H-pyrazole-5-carbonyl chloride?
You can request a quote for 1-Ethyl-3-methyl-1H-pyrazole-5-carbonyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Ethyl-3-methyl-1H-pyrazole-5-carbonyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 1-Ethyl-3-methyl-1H-pyrazole-5-carbonyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.