1,1'-(4,6-Dihydroxy-5-propyl-1,3-phenylene)di(ethan-1-one)
TL;DR: 1,1'-(4,6-Dihydroxy-5-propyl-1,3-phenylene)di(ethan-1-one) (CAS 58806-19-2) is a chemical compound with molecular formula C13H16O4 and molecular weight 236.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-acetyl-2,4-dihydroxy-3-propylphenyl)ethanone
Also Known As: 1-(5-acetyl-2,4-dihydroxy-3-propylphenyl)ethan-1-one, 1-(5-acetyl-2,4-dihydroxy-3-propylphenyl)ethanone, 4,6-Diacetyl-2-propylresorcinol, ethyl 3-oxo-3-phenylpropanoate,thallium(1+), 1-(5-acetyl-2,4-dihydroxy-3-propyl-phenyl)ethanone
| Molecular Formula | C13H16O4 |
|---|---|
| Molecular Weight | 236.10 g/mol |
| LogP | 2.4555 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 236.10486 |
| Heavy Atoms | 17 |
| Complexity | 436.54807 |
Chemical Identifiers
| CAS Number | 58806-19-2 |
|---|---|
| SMILES | CCCC1=C(C(=CC(=C1O)C(=O)C)C(=O)C)O |
Product Overview
1,1'-(4,6-Dihydroxy-5-propyl-1,3-phenylene)di(ethan-1-one) (CAS 58806-19-2), with molecular formula C13H16O4 and molecular weight 236.10 g/mol. IUPAC: 1-(5-acetyl-2,4-dihydroxy-3-propylphenyl)ethanone.
Chemical Property Profile of 1,1'-(4,6-Dihydroxy-5-propyl-1,3-phenylene)di(ethan-1-one)
Property Insights of 1,1'-(4,6-Dihydroxy-5-propyl-1,3-phenylene)di(ethan-1-one)
The XLogP value of 2.4555 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1'-(4,6-Dihydroxy-5-propyl-1,3-phenylene)di(ethan-1-one). The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,1'-(4,6-Dihydroxy-5-propyl-1,3-phenylene)di(ethan-1-one). Following Lipinski's Rule of Five, 1,1'-(4,6-Dihydroxy-5-propyl-1,3-phenylene)di(ethan-1-one) 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 1,1'-(4,6-Dihydroxy-5-propyl-1,3-phenylene)di(ethan-1-one)?
The CAS number of 1,1'-(4,6-Dihydroxy-5-propyl-1,3-phenylene)di(ethan-1-one) is 58806-19-2.
What is the molecular formula of 1,1'-(4,6-Dihydroxy-5-propyl-1,3-phenylene)di(ethan-1-one)?
The molecular formula of 1,1'-(4,6-Dihydroxy-5-propyl-1,3-phenylene)di(ethan-1-one) is C13H16O4.
What is the molecular weight of 1,1'-(4,6-Dihydroxy-5-propyl-1,3-phenylene)di(ethan-1-one)?
The molecular weight of 1,1'-(4,6-Dihydroxy-5-propyl-1,3-phenylene)di(ethan-1-one) is 236.10 g/mol.
Where can I buy 1,1'-(4,6-Dihydroxy-5-propyl-1,3-phenylene)di(ethan-1-one)?
You can request a quote for 1,1'-(4,6-Dihydroxy-5-propyl-1,3-phenylene)di(ethan-1-one) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1'-(4,6-Dihydroxy-5-propyl-1,3-phenylene)di(ethan-1-one)?
Yes, KEHONG BIO provides custom synthesis services for 1,1'-(4,6-Dihydroxy-5-propyl-1,3-phenylene)di(ethan-1-one) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.