1-(2,3,4,5-Tetramethylphenyl)-1-butanone
TL;DR: 1-(2,3,4,5-Tetramethylphenyl)-1-butanone (CAS 69855-49-8) 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.
1-(2,3,4,5-tetramethylphenyl)butan-1-one
Also Known As: 1- -1-butanone, 1-(2,3,4,5-Tetramethylphenyl)-1-butanone, 1-(2,3,4,5-tetramethylphenyl)butan-1-one, 1-Butanone, 1-(2,3,4,5-tetramethylphenyl)-
| Molecular Formula | C14H20O |
|---|---|
| Molecular Weight | 204.15 g/mol |
| LogP | 3.90308 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 204.15141 |
| Heavy Atoms | 15 |
| Complexity | 388.81543 |
Chemical Identifiers
| CAS Number | 69855-49-8 |
|---|---|
| SMILES | CCCC(=O)C1=C(C(=C(C(=C1)C)C)C)C |
Product Overview
1-(2,3,4,5-Tetramethylphenyl)-1-butanone (CAS 69855-49-8), with molecular formula C14H20O and molecular weight 204.15 g/mol. IUPAC: 1-(2,3,4,5-tetramethylphenyl)butan-1-one.
Chemical Property Profile of 1-(2,3,4,5-Tetramethylphenyl)-1-butanone
Property Insights of 1-(2,3,4,5-Tetramethylphenyl)-1-butanone
The XLogP value of 3.90308 indicates that 1-(2,3,4,5-Tetramethylphenyl)-1-butanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 1-(2,3,4,5-Tetramethylphenyl)-1-butanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2,3,4,5-Tetramethylphenyl)-1-butanone 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 1-(2,3,4,5-Tetramethylphenyl)-1-butanone?
The CAS number of 1-(2,3,4,5-Tetramethylphenyl)-1-butanone is 69855-49-8.
What is the molecular formula of 1-(2,3,4,5-Tetramethylphenyl)-1-butanone?
The molecular formula of 1-(2,3,4,5-Tetramethylphenyl)-1-butanone is C14H20O.
What is the molecular weight of 1-(2,3,4,5-Tetramethylphenyl)-1-butanone?
The molecular weight of 1-(2,3,4,5-Tetramethylphenyl)-1-butanone is 204.15 g/mol.
Where can I buy 1-(2,3,4,5-Tetramethylphenyl)-1-butanone?
You can request a quote for 1-(2,3,4,5-Tetramethylphenyl)-1-butanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2,3,4,5-Tetramethylphenyl)-1-butanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,3,4,5-Tetramethylphenyl)-1-butanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.