4-Heptyl-1H-pyrazole
TL;DR: 4-Heptyl-1H-pyrazole (CAS 14766-44-0) is a chemical compound with molecular formula C10H18N2 and molecular weight 166.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-heptyl-1H-pyrazole
Also Known As: 4-Heptylpyrazole, 4-heptyl-1H-pyrazole, 1H-Pyrazole, 4-heptyl-, RefChem:912528
| Molecular Formula | C10H18N2 |
|---|---|
| Molecular Weight | 166.15 g/mol |
| LogP | 2.9226 |
| Topological Polar Surface Area | 28.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 166.147 |
| Heavy Atoms | 12 |
| Complexity | 179.72847 |
Chemical Identifiers
| CAS Number | 14766-44-0 |
|---|---|
| SMILES | CCCCCCCC1=CNN=C1 |
Product Overview
4-Heptyl-1H-pyrazole (CAS 14766-44-0), with molecular formula C10H18N2 and molecular weight 166.15 g/mol. IUPAC: 4-heptyl-1H-pyrazole.
Chemical Property Profile of 4-Heptyl-1H-pyrazole
Property Insights of 4-Heptyl-1H-pyrazole
The XLogP value of 2.9226 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Heptyl-1H-pyrazole. With a topological polar surface area (TPSA) of 28.68 Ų, 4-Heptyl-1H-pyrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Heptyl-1H-pyrazole has 1 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 4-Heptyl-1H-pyrazole?
The CAS number of 4-Heptyl-1H-pyrazole is 14766-44-0.
What is the molecular formula of 4-Heptyl-1H-pyrazole?
The molecular formula of 4-Heptyl-1H-pyrazole is C10H18N2.
What is the molecular weight of 4-Heptyl-1H-pyrazole?
The molecular weight of 4-Heptyl-1H-pyrazole is 166.15 g/mol.
Where can I buy 4-Heptyl-1H-pyrazole?
You can request a quote for 4-Heptyl-1H-pyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Heptyl-1H-pyrazole?
Yes, KEHONG BIO provides custom synthesis services for 4-Heptyl-1H-pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.