2,4,6-三甲基苯基异丁基酮
TL;DR: 2,4,6-三甲基苯基异丁基酮 (CAS 59315-50-3) is a chemical compound with molecular formula C14H20O and molecular weight 204.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4,6-三甲基苯基异丁基酮
3-methyl-1-(2,4,6-trimethylphenyl)butan-1-one
Also Known As: 2,4,6-Trimethylphenyl isobutyl ketone, starbld0049011, 1-Mesityl-3-methylbutan-1-one, 2',3,4',6'-Tetramethylbutyrophenone, 3-methyl-1-(2,4,6-trimethylphenyl)butan-1-one
| Molecular Formula | C14H20O |
|---|---|
| Molecular Weight | 204.15 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 204.15141 |
| Heavy Atoms | 15 |
| Complexity | 207.0 |
Chemical Identifiers
| CAS Number | 59315-50-3 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)C)C(=O)CC(C)C)C |
| InChIKey | BUCULLODNNKZEI-UHFFFAOYSA-N |
Product Overview
2,4,6-三甲基苯基异丁基酮 (CAS 59315-50-3), with molecular formula C14H20O and molecular weight 204.15 g/mol. IUPAC: 3-methyl-1-(2,4,6-trimethylphenyl)butan-1-one.
Chemical Property Profile of 2,4,6-三甲基苯基异丁基酮
Property Insights of 2,4,6-三甲基苯基异丁基酮
The XLogP value of 4.0 indicates that 2,4,6-三甲基苯基异丁基酮 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 2,4,6-三甲基苯基异丁基酮 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4,6-三甲基苯基异丁基酮 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 2,4,6-三甲基苯基异丁基酮?
The CAS number of 2,4,6-三甲基苯基异丁基酮 is 59315-50-3.
What is the molecular formula of 2,4,6-三甲基苯基异丁基酮?
The molecular formula of 2,4,6-三甲基苯基异丁基酮 is C14H20O.
What is the molecular weight of 2,4,6-三甲基苯基异丁基酮?
The molecular weight of 2,4,6-三甲基苯基异丁基酮 is 204.15 g/mol.
Where can I buy 2,4,6-三甲基苯基异丁基酮?
You can request a quote for 2,4,6-三甲基苯基异丁基酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4,6-三甲基苯基异丁基酮?
Yes, KEHONG BIO provides custom synthesis services for 2,4,6-三甲基苯基异丁基酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.