4-Isopropylpyridine
TL;DR: 4-Isopropylpyridine (CAS 696-30-0) is a chemical compound with molecular formula C8H11N and molecular weight 121.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-propan-2-ylpyridine
Also Known As: 4-Isopropylpyridine, 4-Isopropyl-pyridine, 4-propan-2-ylpyridine, Pyridine, 4-(1-methylethyl)-, 4-isopropyl pyridine
| Molecular Formula | C8H11N |
|---|---|
| Molecular Weight | 121.09 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 12.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 121.08915 |
| Heavy Atoms | 9 |
| Complexity | 72.0 |
Chemical Identifiers
| CAS Number | 696-30-0 |
|---|---|
| SMILES | CC(C)C1=CC=NC=C1 |
| InChIKey | FRGXNJWEDDQLFH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Isopropylpyridine (CAS 696-30-0), with molecular formula C8H11N and molecular weight 121.09 g/mol. IUPAC: 4-propan-2-ylpyridine.
Chemical Property Profile of 4-Isopropylpyridine
Property Insights of 4-Isopropylpyridine
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Isopropylpyridine. With a topological polar surface area (TPSA) of 12.9 Ų, 4-Isopropylpyridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Isopropylpyridine 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 4-Isopropylpyridine?
The CAS number of 4-Isopropylpyridine is 696-30-0.
What is the molecular formula of 4-Isopropylpyridine?
The molecular formula of 4-Isopropylpyridine is C8H11N.
What is the molecular weight of 4-Isopropylpyridine?
The molecular weight of 4-Isopropylpyridine is 121.09 g/mol.
Where can I buy 4-Isopropylpyridine?
You can request a quote for 4-Isopropylpyridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Isopropylpyridine?
Yes, KEHONG BIO provides custom synthesis services for 4-Isopropylpyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.