Isopropylquinoline (mixed isomers)
TL;DR: Isopropylquinoline (mixed isomers) (CAS 1333-53-5) is a chemical compound with molecular formula C12H13N and molecular weight 171.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-propan-2-ylquinoline
Also Known As: Lichenol, Isopropylquinoline, 4-Isopropylquinoline, Isopropyl quinoline, Quinoline, (1-methylethyl)-
| Molecular Formula | C12H13N |
|---|---|
| Molecular Weight | 171.10 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 12.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 171.1048 |
| Heavy Atoms | 13 |
| Complexity | 165.0 |
Chemical Identifiers
| CAS Number | 1333-53-5 |
|---|---|
| SMILES | CC(C)C1=CC=NC2=CC=CC=C12 |
| InChIKey | HFYWOOUKPVJGBA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Isopropylquinoline (mixed isomers) (CAS 1333-53-5), with molecular formula C12H13N and molecular weight 171.10 g/mol. IUPAC: 4-propan-2-ylquinoline.
Chemical Property Profile of Isopropylquinoline (mixed isomers)
Property Insights of Isopropylquinoline (mixed isomers)
The XLogP value of 3.4 indicates that Isopropylquinoline (mixed isomers) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.9 Ų, Isopropylquinoline (mixed isomers) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isopropylquinoline (mixed isomers) 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 Isopropylquinoline (mixed isomers)?
The CAS number of Isopropylquinoline (mixed isomers) is 1333-53-5.
What is the molecular formula of Isopropylquinoline (mixed isomers)?
The molecular formula of Isopropylquinoline (mixed isomers) is C12H13N.
What is the molecular weight of Isopropylquinoline (mixed isomers)?
The molecular weight of Isopropylquinoline (mixed isomers) is 171.10 g/mol.
Where can I buy Isopropylquinoline (mixed isomers)?
You can request a quote for Isopropylquinoline (mixed isomers) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isopropylquinoline (mixed isomers)?
Yes, KEHONG BIO provides custom synthesis services for Isopropylquinoline (mixed isomers) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.