Nezukone
TL;DR: Nezukone (CAS 13656-81-0) is a chemical compound with molecular formula C10H12O and molecular weight 148.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-propan-2-ylcyclohepta-2,4,6-trien-1-one
Also Known As: Nezukone, 4-Isopropyltropone, Nezukon, 2,4,6-Cycloheptatrien-1-one, 4-isopropyl-, 4-propan-2-ylcyclohepta-2,4,6-trien-1-one
| Molecular Formula | C10H12O |
|---|---|
| Molecular Weight | 148.09 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 148.08882 |
| Heavy Atoms | 11 |
| Complexity | 242.0 |
Chemical Identifiers
| CAS Number | 13656-81-0 |
|---|---|
| SMILES | CC(C)C1=CC=CC(=O)C=C1 |
| InChIKey | IWPWMAJDSLSRIP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Nezukone (CAS 13656-81-0), with molecular formula C10H12O and molecular weight 148.09 g/mol. IUPAC: 4-propan-2-ylcyclohepta-2,4,6-trien-1-one.
Chemical Property Profile of Nezukone
Property Insights of Nezukone
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Nezukone. With a topological polar surface area (TPSA) of 17.1 Ų, Nezukone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Nezukone 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 Nezukone?
The CAS number of Nezukone is 13656-81-0.
What is the molecular formula of Nezukone?
The molecular formula of Nezukone is C10H12O.
What is the molecular weight of Nezukone?
The molecular weight of Nezukone is 148.09 g/mol.
Where can I buy Nezukone?
You can request a quote for Nezukone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nezukone?
Yes, KEHONG BIO provides custom synthesis services for Nezukone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.