1-Hexyl-3,5-dimethyl-1H-pyrazole
TL;DR: 1-Hexyl-3,5-dimethyl-1H-pyrazole (CAS 24475-41-0) is a chemical compound with molecular formula C11H20N2 and molecular weight 180.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-hexyl-3,5-dimethylpyrazole
Also Known As: 3,5-Dimethyl-1-hexylpyrazole, 1-Hexyl-3,5-dimethyl-1H-pyrazole, 1-hexyl-3,5-dimethylpyrazole, 1-Hexyl-3,5-dimethyl-1H-pyrazole #
| Molecular Formula | C11H20N2 |
|---|---|
| Molecular Weight | 180.16 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 17.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 180.16264 |
| Heavy Atoms | 13 |
| Complexity | 136.0 |
Chemical Identifiers
| CAS Number | 24475-41-0 |
|---|---|
| SMILES | CCCCCCN1C(=CC(=N1)C)C |
| InChIKey | XTOQAEWQESNBAS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Hexyl-3,5-dimethyl-1H-pyrazole (CAS 24475-41-0), with molecular formula C11H20N2 and molecular weight 180.16 g/mol. IUPAC: 1-hexyl-3,5-dimethylpyrazole.
Chemical Property Profile of 1-Hexyl-3,5-dimethyl-1H-pyrazole
Property Insights of 1-Hexyl-3,5-dimethyl-1H-pyrazole
The XLogP value of 3.3 indicates that 1-Hexyl-3,5-dimethyl-1H-pyrazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.8 Ų, 1-Hexyl-3,5-dimethyl-1H-pyrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Hexyl-3,5-dimethyl-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 1-Hexyl-3,5-dimethyl-1H-pyrazole?
The CAS number of 1-Hexyl-3,5-dimethyl-1H-pyrazole is 24475-41-0.
What is the molecular formula of 1-Hexyl-3,5-dimethyl-1H-pyrazole?
The molecular formula of 1-Hexyl-3,5-dimethyl-1H-pyrazole is C11H20N2.
What is the molecular weight of 1-Hexyl-3,5-dimethyl-1H-pyrazole?
The molecular weight of 1-Hexyl-3,5-dimethyl-1H-pyrazole is 180.16 g/mol.
Where can I buy 1-Hexyl-3,5-dimethyl-1H-pyrazole?
You can request a quote for 1-Hexyl-3,5-dimethyl-1H-pyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Hexyl-3,5-dimethyl-1H-pyrazole?
Yes, KEHONG BIO provides custom synthesis services for 1-Hexyl-3,5-dimethyl-1H-pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.