Dimethylphenylpyrazole
TL;DR: Dimethylphenylpyrazole (CAS 1131-16-4) is a chemical compound with molecular formula C11H12N2 and molecular weight 172.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dimethyl-1-phenylpyrazole
Also Known As: 3,5-Dimethyl-1-phenylpyrazole, 3,5-Dimethyl-1-phenyl-1H-pyrazole, Dimethylphenylpyrazole, Phenyldimethylpyrazole, 1H-Pyrazole, 3,5-dimethyl-1-phenyl-
| Molecular Formula | C11H12N2 |
|---|---|
| Molecular Weight | 172.10 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 17.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 172.10005 |
| Heavy Atoms | 13 |
| Complexity | 163.0 |
Chemical Identifiers
| CAS Number | 1131-16-4 |
|---|---|
| SMILES | CC1=CC(=NN1C2=CC=CC=C2)C |
| InChIKey | ULPMPUPEFBDQQA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dimethylphenylpyrazole (CAS 1131-16-4), with molecular formula C11H12N2 and molecular weight 172.10 g/mol. IUPAC: 3,5-dimethyl-1-phenylpyrazole.
Chemical Property Profile of Dimethylphenylpyrazole
Property Insights of Dimethylphenylpyrazole
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethylphenylpyrazole. With a topological polar surface area (TPSA) of 17.8 Ų, Dimethylphenylpyrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dimethylphenylpyrazole 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 Dimethylphenylpyrazole?
The CAS number of Dimethylphenylpyrazole is 1131-16-4.
What is the molecular formula of Dimethylphenylpyrazole?
The molecular formula of Dimethylphenylpyrazole is C11H12N2.
What is the molecular weight of Dimethylphenylpyrazole?
The molecular weight of Dimethylphenylpyrazole is 172.10 g/mol.
Where can I buy Dimethylphenylpyrazole?
You can request a quote for Dimethylphenylpyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethylphenylpyrazole?
Yes, KEHONG BIO provides custom synthesis services for Dimethylphenylpyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.