3,4,5-Trimethyl-1-phenylpyrazole
TL;DR: 3,4,5-Trimethyl-1-phenylpyrazole (CAS 10252-57-0) is a chemical compound with molecular formula C12H14N2 and molecular weight 186.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4,5-trimethyl-1-phenylpyrazole
Also Known As: 3,4,5-Trimethyl-1-phenylpyrazole, 3,4,5-Trimethyl-1-phenyl-1H-pyrazole, 1-Phenyl-3,4,5-trimethyl-pyrazol, 1-Phenyl-3,4,5-trimethyl-1H-pyrazole, 3,4,5-Trimethyl-1-phenyl-1H-pyrazole #
| Molecular Formula | C12H14N2 |
|---|---|
| Molecular Weight | 186.12 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 17.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 186.11569 |
| Heavy Atoms | 14 |
| Complexity | 187.0 |
Chemical Identifiers
| CAS Number | 10252-57-0 |
|---|---|
| SMILES | CC1=C(N(N=C1C)C2=CC=CC=C2)C |
| InChIKey | UZHVNGNURWBNRG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,4,5-Trimethyl-1-phenylpyrazole (CAS 10252-57-0), with molecular formula C12H14N2 and molecular weight 186.12 g/mol. IUPAC: 3,4,5-trimethyl-1-phenylpyrazole.
Chemical Property Profile of 3,4,5-Trimethyl-1-phenylpyrazole
Property Insights of 3,4,5-Trimethyl-1-phenylpyrazole
The XLogP value of 3.1 indicates that 3,4,5-Trimethyl-1-phenylpyrazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.8 Ų, 3,4,5-Trimethyl-1-phenylpyrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4,5-Trimethyl-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 3,4,5-Trimethyl-1-phenylpyrazole?
The CAS number of 3,4,5-Trimethyl-1-phenylpyrazole is 10252-57-0.
What is the molecular formula of 3,4,5-Trimethyl-1-phenylpyrazole?
The molecular formula of 3,4,5-Trimethyl-1-phenylpyrazole is C12H14N2.
What is the molecular weight of 3,4,5-Trimethyl-1-phenylpyrazole?
The molecular weight of 3,4,5-Trimethyl-1-phenylpyrazole is 186.12 g/mol.
Where can I buy 3,4,5-Trimethyl-1-phenylpyrazole?
You can request a quote for 3,4,5-Trimethyl-1-phenylpyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4,5-Trimethyl-1-phenylpyrazole?
Yes, KEHONG BIO provides custom synthesis services for 3,4,5-Trimethyl-1-phenylpyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.