2,6,8-Trimethyl-4-nonanone
TL;DR: 2,6,8-Trimethyl-4-nonanone (CAS 123-18-2) is a chemical compound with molecular formula C12H24O and molecular weight 184.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6,8-trimethylnonan-4-one
Also Known As: 2,6,8-Trimethyl-4-nonanone, 2,6,8-Trimethylnonan-4-one, Isobutyl heptyl ketone, 4-NONANONE, 2,6,8-TRIMETHYL-, 2,8-Trimethyl-4-nonanone
| Molecular Formula | C12H24O |
|---|---|
| Molecular Weight | 184.18 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 184.18271 |
| Heavy Atoms | 13 |
| Complexity | 147.0 |
Chemical Identifiers
| CAS Number | 123-18-2 |
|---|---|
| SMILES | CC(C)CC(C)CC(=O)CC(C)C |
| InChIKey | GFWVDQCGGDBTBS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,6,8-Trimethyl-4-nonanone (CAS 123-18-2), with molecular formula C12H24O and molecular weight 184.18 g/mol. IUPAC: 2,6,8-trimethylnonan-4-one.
Chemical Property Profile of 2,6,8-Trimethyl-4-nonanone
Property Insights of 2,6,8-Trimethyl-4-nonanone
The XLogP value of 3.8 indicates that 2,6,8-Trimethyl-4-nonanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 2,6,8-Trimethyl-4-nonanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6,8-Trimethyl-4-nonanone 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 2,6,8-Trimethyl-4-nonanone?
The CAS number of 2,6,8-Trimethyl-4-nonanone is 123-18-2.
What is the molecular formula of 2,6,8-Trimethyl-4-nonanone?
The molecular formula of 2,6,8-Trimethyl-4-nonanone is C12H24O.
What is the molecular weight of 2,6,8-Trimethyl-4-nonanone?
The molecular weight of 2,6,8-Trimethyl-4-nonanone is 184.18 g/mol.
Where can I buy 2,6,8-Trimethyl-4-nonanone?
You can request a quote for 2,6,8-Trimethyl-4-nonanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6,8-Trimethyl-4-nonanone?
Yes, KEHONG BIO provides custom synthesis services for 2,6,8-Trimethyl-4-nonanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.