2-Propanone, 1-(2-(acetyloxy)-5-hydroxy-3,4,6-trimethylphenyl)-
TL;DR: 2-Propanone, 1-(2-(acetyloxy)-5-hydroxy-3,4,6-trimethylphenyl)- (CAS 68591-15-1) is a chemical compound with molecular formula C14H18O4 and molecular weight 250.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-hydroxy-2,3,5-trimethyl-6-(2-oxopropyl)phenyl] acetate
Also Known As: 4-08-00-01894 (Beilstein Handbook Reference), 2-Propanone, 1-(2-(acetyloxy)-5-hydroxy-3,4,6-trimethylphenyl)-, 1-(2-(Acetyloxy)-5-hydroxy-3,4,6-trimethylphenyl)-2-propanone, [4-hydroxy-2,3,5-trimethyl-6-(2-oxopropyl)phenyl] acetate, 4-HYDROXY-2,3,5-TRIMETHYL-6-(2-OXOPROPYL)PHENYL ACETATE
| Molecular Formula | C14H18O4 |
|---|---|
| Molecular Weight | 250.12 g/mol |
| LogP | 2.37426 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 250.12051 |
| Heavy Atoms | 18 |
| Complexity | 468.26065 |
Chemical Identifiers
| CAS Number | 68591-15-1 |
|---|---|
| SMILES | CC1=C(C(=C(C(=C1O)C)CC(=O)C)OC(=O)C)C |
Product Overview
2-Propanone, 1-(2-(acetyloxy)-5-hydroxy-3,4,6-trimethylphenyl)- (CAS 68591-15-1), with molecular formula C14H18O4 and molecular weight 250.12 g/mol. IUPAC: [4-hydroxy-2,3,5-trimethyl-6-(2-oxopropyl)phenyl] acetate.
Chemical Property Profile of 2-Propanone, 1-(2-(acetyloxy)-5-hydroxy-3,4,6-trimethylphenyl)-
Property Insights of 2-Propanone, 1-(2-(acetyloxy)-5-hydroxy-3,4,6-trimethylphenyl)-
The XLogP value of 2.37426 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Propanone, 1-(2-(acetyloxy)-5-hydroxy-3,4,6-trimethylphenyl)-. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Propanone, 1-(2-(acetyloxy)-5-hydroxy-3,4,6-trimethylphenyl)-. Following Lipinski's Rule of Five, 2-Propanone, 1-(2-(acetyloxy)-5-hydroxy-3,4,6-trimethylphenyl)- has 1 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 2-Propanone, 1-(2-(acetyloxy)-5-hydroxy-3,4,6-trimethylphenyl)-?
The CAS number of 2-Propanone, 1-(2-(acetyloxy)-5-hydroxy-3,4,6-trimethylphenyl)- is 68591-15-1.
What is the molecular formula of 2-Propanone, 1-(2-(acetyloxy)-5-hydroxy-3,4,6-trimethylphenyl)-?
The molecular formula of 2-Propanone, 1-(2-(acetyloxy)-5-hydroxy-3,4,6-trimethylphenyl)- is C14H18O4.
What is the molecular weight of 2-Propanone, 1-(2-(acetyloxy)-5-hydroxy-3,4,6-trimethylphenyl)-?
The molecular weight of 2-Propanone, 1-(2-(acetyloxy)-5-hydroxy-3,4,6-trimethylphenyl)- is 250.12 g/mol.
Where can I buy 2-Propanone, 1-(2-(acetyloxy)-5-hydroxy-3,4,6-trimethylphenyl)-?
You can request a quote for 2-Propanone, 1-(2-(acetyloxy)-5-hydroxy-3,4,6-trimethylphenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propanone, 1-(2-(acetyloxy)-5-hydroxy-3,4,6-trimethylphenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Propanone, 1-(2-(acetyloxy)-5-hydroxy-3,4,6-trimethylphenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.