1-(o-Ethylphenyl)-3-methyl-2-pyrazolin-5-one
TL;DR: 1-(o-Ethylphenyl)-3-methyl-2-pyrazolin-5-one (CAS 131-65-7) is a chemical compound with molecular formula C12H14N2O and molecular weight 202.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-ethylphenyl)-5-methyl-4H-pyrazol-3-one
Also Known As: 1-(o-Ethylphenyl)-3-methyl-2-pyrazolin-5-one, 3H-Pyrazol-3-one, 2-(2-ethylphenyl)-2,4-dihydro-5-methyl-, 2-(2-ethylphenyl)-5-methyl-4H-pyrazol-3-one, 2,4-Dihydro-3-methyl-2-phenethyl-3H-pyrazol-3-one, 1-(2-Ethylphenyl)-3-methyl-2-pyrazolin-5-on
| Molecular Formula | C12H14N2O |
|---|---|
| Molecular Weight | 202.11 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 32.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 202.11061 |
| Heavy Atoms | 15 |
| Complexity | 285.0 |
Chemical Identifiers
| CAS Number | 131-65-7 |
|---|---|
| SMILES | CCC1=CC=CC=C1N2C(=O)CC(=N2)C |
| InChIKey | HKFAMUCGCCUZMC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(o-Ethylphenyl)-3-methyl-2-pyrazolin-5-one (CAS 131-65-7), with molecular formula C12H14N2O and molecular weight 202.11 g/mol. IUPAC: 2-(2-ethylphenyl)-5-methyl-4H-pyrazol-3-one.
Chemical Property Profile of 1-(o-Ethylphenyl)-3-methyl-2-pyrazolin-5-one
Property Insights of 1-(o-Ethylphenyl)-3-methyl-2-pyrazolin-5-one
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(o-Ethylphenyl)-3-methyl-2-pyrazolin-5-one. With a topological polar surface area (TPSA) of 32.7 Ų, 1-(o-Ethylphenyl)-3-methyl-2-pyrazolin-5-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(o-Ethylphenyl)-3-methyl-2-pyrazolin-5-one 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-(o-Ethylphenyl)-3-methyl-2-pyrazolin-5-one?
The CAS number of 1-(o-Ethylphenyl)-3-methyl-2-pyrazolin-5-one is 131-65-7.
What is the molecular formula of 1-(o-Ethylphenyl)-3-methyl-2-pyrazolin-5-one?
The molecular formula of 1-(o-Ethylphenyl)-3-methyl-2-pyrazolin-5-one is C12H14N2O.
What is the molecular weight of 1-(o-Ethylphenyl)-3-methyl-2-pyrazolin-5-one?
The molecular weight of 1-(o-Ethylphenyl)-3-methyl-2-pyrazolin-5-one is 202.11 g/mol.
Where can I buy 1-(o-Ethylphenyl)-3-methyl-2-pyrazolin-5-one?
You can request a quote for 1-(o-Ethylphenyl)-3-methyl-2-pyrazolin-5-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(o-Ethylphenyl)-3-methyl-2-pyrazolin-5-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(o-Ethylphenyl)-3-methyl-2-pyrazolin-5-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.