1-(5-Butyryl-2,4-dihydroxy-3-methylphenyl)-1-butanone
TL;DR: 1-(5-Butyryl-2,4-dihydroxy-3-methylphenyl)-1-butanone (CAS 500193-61-3) is a chemical compound with molecular formula C15H20O4 and molecular weight 264.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-butanoyl-2,4-dihydroxy-3-methylphenyl)butan-1-one
Also Known As: 1-(5-butyryl-2,4-dihydroxy-3-methylphenyl)-1-butanone, AP-960/41299748, 1-(5-butanoyl-2,4-dihydroxy-3-methylphenyl)butan-1-one
| Molecular Formula | C15H20O4 |
|---|---|
| Molecular Weight | 264.14 g/mol |
| LogP | 3.37182 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 264.13617 |
| Heavy Atoms | 19 |
| Complexity | 461.1073 |
Chemical Identifiers
| CAS Number | 500193-61-3 |
|---|---|
| SMILES | CCCC(=O)C1=CC(=C(C(=C1O)C)O)C(=O)CCC |
Product Overview
1-(5-Butyryl-2,4-dihydroxy-3-methylphenyl)-1-butanone (CAS 500193-61-3), with molecular formula C15H20O4 and molecular weight 264.14 g/mol. IUPAC: 1-(5-butanoyl-2,4-dihydroxy-3-methylphenyl)butan-1-one.
Chemical Property Profile of 1-(5-Butyryl-2,4-dihydroxy-3-methylphenyl)-1-butanone
Property Insights of 1-(5-Butyryl-2,4-dihydroxy-3-methylphenyl)-1-butanone
The XLogP value of 3.37182 indicates that 1-(5-Butyryl-2,4-dihydroxy-3-methylphenyl)-1-butanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(5-Butyryl-2,4-dihydroxy-3-methylphenyl)-1-butanone. Following Lipinski's Rule of Five, 1-(5-Butyryl-2,4-dihydroxy-3-methylphenyl)-1-butanone has 2 hydrogen bond donor(s) and 4 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-(5-Butyryl-2,4-dihydroxy-3-methylphenyl)-1-butanone?
The CAS number of 1-(5-Butyryl-2,4-dihydroxy-3-methylphenyl)-1-butanone is 500193-61-3.
What is the molecular formula of 1-(5-Butyryl-2,4-dihydroxy-3-methylphenyl)-1-butanone?
The molecular formula of 1-(5-Butyryl-2,4-dihydroxy-3-methylphenyl)-1-butanone is C15H20O4.
What is the molecular weight of 1-(5-Butyryl-2,4-dihydroxy-3-methylphenyl)-1-butanone?
The molecular weight of 1-(5-Butyryl-2,4-dihydroxy-3-methylphenyl)-1-butanone is 264.14 g/mol.
Where can I buy 1-(5-Butyryl-2,4-dihydroxy-3-methylphenyl)-1-butanone?
You can request a quote for 1-(5-Butyryl-2,4-dihydroxy-3-methylphenyl)-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-(5-Butyryl-2,4-dihydroxy-3-methylphenyl)-1-butanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(5-Butyryl-2,4-dihydroxy-3-methylphenyl)-1-butanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.