1-Phenylpyrazole
TL;DR: 1-Phenylpyrazole (CAS 1126-00-7) is a chemical compound with molecular formula C9H8N2 and molecular weight 144.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenylpyrazole
Also Known As: 1-Phenylpyrazole, 1-Phenyl-1H-pyrazole, N-Phenylpyrazole, 1H-Pyrazole, 1-phenyl-, Pyrazole, 1-phenyl-
| Molecular Formula | C9H8N2 |
|---|---|
| Molecular Weight | 144.07 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 17.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 144.06874 |
| Heavy Atoms | 11 |
| Complexity | 119.0 |
Chemical Identifiers
| CAS Number | 1126-00-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C=CC=N2 |
| InChIKey | WITMXBRCQWOZPX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Phenylpyrazole (CAS 1126-00-7), with molecular formula C9H8N2 and molecular weight 144.07 g/mol. IUPAC: 1-phenylpyrazole.
Chemical Property Profile of 1-Phenylpyrazole
Property Insights of 1-Phenylpyrazole
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Phenylpyrazole. With a topological polar surface area (TPSA) of 17.8 Ų, 1-Phenylpyrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Phenylpyrazole 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 1-Phenylpyrazole?
The CAS number of 1-Phenylpyrazole is 1126-00-7.
What is the molecular formula of 1-Phenylpyrazole?
The molecular formula of 1-Phenylpyrazole is C9H8N2.
What is the molecular weight of 1-Phenylpyrazole?
The molecular weight of 1-Phenylpyrazole is 144.07 g/mol.
Where can I buy 1-Phenylpyrazole?
You can request a quote for 1-Phenylpyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Phenylpyrazole?
Yes, KEHONG BIO provides custom synthesis services for 1-Phenylpyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.