1-(4-bromo-1-methyl-1H-pyrazol-5-yl)ethanone
TL;DR: 1-(4-bromo-1-methyl-1H-pyrazol-5-yl)ethanone (CAS 925205-59-0) is a chemical compound with molecular formula C6H7BrN2O and molecular weight 201.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-bromo-1-methylpyrazol-5-yl)ethanone
Also Known As: 1-(4-bromo-1-methyl-1H-pyrazol-5-yl)ethanone, 1-(4-bromo-2-methylpyrazol-3-yl)ethanone, 5-acetyl-4-bromo-1-methylpyrazole, 1-(4-Bromo-2-methyl-2H-pyrazol-3-yl)-ethanone, 1-(4-bromo-1-methyl-1H-pyrazol-5-yl)ethan-1-one
| Molecular Formula | C6H7BrN2O |
|---|---|
| Molecular Weight | 201.97 g/mol |
| LogP | 1.3852 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 201.97418 |
| Heavy Atoms | 10 |
| Complexity | 247.21158 |
Chemical Identifiers
| CAS Number | 925205-59-0 |
|---|---|
| SMILES | CC(=O)C1=C(C=NN1C)Br |
Product Overview
1-(4-bromo-1-methyl-1H-pyrazol-5-yl)ethanone (CAS 925205-59-0), with molecular formula C6H7BrN2O and molecular weight 201.97 g/mol. IUPAC: 1-(4-bromo-1-methylpyrazol-5-yl)ethanone.
Chemical Property Profile of 1-(4-bromo-1-methyl-1H-pyrazol-5-yl)ethanone
Property Insights of 1-(4-bromo-1-methyl-1H-pyrazol-5-yl)ethanone
The XLogP value of 1.3852 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-bromo-1-methyl-1H-pyrazol-5-yl)ethanone. With a topological polar surface area (TPSA) of 34.89 Ų, 1-(4-bromo-1-methyl-1H-pyrazol-5-yl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-bromo-1-methyl-1H-pyrazol-5-yl)ethanone 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-(4-bromo-1-methyl-1H-pyrazol-5-yl)ethanone?
The CAS number of 1-(4-bromo-1-methyl-1H-pyrazol-5-yl)ethanone is 925205-59-0.
What is the molecular formula of 1-(4-bromo-1-methyl-1H-pyrazol-5-yl)ethanone?
The molecular formula of 1-(4-bromo-1-methyl-1H-pyrazol-5-yl)ethanone is C6H7BrN2O.
What is the molecular weight of 1-(4-bromo-1-methyl-1H-pyrazol-5-yl)ethanone?
The molecular weight of 1-(4-bromo-1-methyl-1H-pyrazol-5-yl)ethanone is 201.97 g/mol.
Where can I buy 1-(4-bromo-1-methyl-1H-pyrazol-5-yl)ethanone?
You can request a quote for 1-(4-bromo-1-methyl-1H-pyrazol-5-yl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-bromo-1-methyl-1H-pyrazol-5-yl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-bromo-1-methyl-1H-pyrazol-5-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.