5-Methyl-1-phenyl-1H-pyrazole
TL;DR: 5-Methyl-1-phenyl-1H-pyrazole (CAS 6831-91-0) is a chemical compound with molecular formula C10H10N2 and molecular weight 158.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-1-phenylpyrazole
Also Known As: 5-Methyl-1-phenyl-1H-pyrazole, 5-Methyl-1-phenylpyrazole, isooctyltrimethoxysilane, 1H-Pyrazole, 5-methyl-1-phenyl-, Pyrazole, 5-methyl-1-phenyl-
| Molecular Formula | C10H10N2 |
|---|---|
| Molecular Weight | 158.08 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 17.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 158.0844 |
| Heavy Atoms | 12 |
| Complexity | 141.0 |
Chemical Identifiers
| CAS Number | 6831-91-0 |
|---|---|
| SMILES | CC1=CC=NN1C2=CC=CC=C2 |
| InChIKey | GIPOQOUSJKAZMC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Methyl-1-phenyl-1H-pyrazole (CAS 6831-91-0), with molecular formula C10H10N2 and molecular weight 158.08 g/mol. IUPAC: 5-methyl-1-phenylpyrazole.
Chemical Property Profile of 5-Methyl-1-phenyl-1H-pyrazole
Property Insights of 5-Methyl-1-phenyl-1H-pyrazole
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Methyl-1-phenyl-1H-pyrazole. With a topological polar surface area (TPSA) of 17.8 Ų, 5-Methyl-1-phenyl-1H-pyrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Methyl-1-phenyl-1H-pyrazole has 0 hydrogen bond donor(s) and 1 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 5-Methyl-1-phenyl-1H-pyrazole?
The CAS number of 5-Methyl-1-phenyl-1H-pyrazole is 6831-91-0.
What is the molecular formula of 5-Methyl-1-phenyl-1H-pyrazole?
The molecular formula of 5-Methyl-1-phenyl-1H-pyrazole is C10H10N2.
What is the molecular weight of 5-Methyl-1-phenyl-1H-pyrazole?
The molecular weight of 5-Methyl-1-phenyl-1H-pyrazole is 158.08 g/mol.
Where can I buy 5-Methyl-1-phenyl-1H-pyrazole?
You can request a quote for 5-Methyl-1-phenyl-1H-pyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Methyl-1-phenyl-1H-pyrazole?
Yes, KEHONG BIO provides custom synthesis services for 5-Methyl-1-phenyl-1H-pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.