1-(2,4,6-Trihydroxy-3,5-dimethylphenyl)ethanone
TL;DR: 1-(2,4,6-Trihydroxy-3,5-dimethylphenyl)ethanone (CAS 13383-63-6) is a chemical compound with molecular formula C10H12O4 and molecular weight 196.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,4,6-trihydroxy-3,5-dimethylphenyl)ethanone
Also Known As: 1-(2,4,6-trihydroxy-3,5-dimethylphenyl)ethanone, 1-(2,4,6-Trihydroxy-3,5-dimethylphenyl)ethan-1-one, Phloroacetophenone,3',5'-dimethyl-(6CI), Ethanone,1-(2,4,6-trihydroxy-3,5-dimethylphenyl)-, 2 ,4 ,6 -Trihydroxy-3 ,5 -dimethylacetophenone
| Molecular Formula | C10H12O4 |
|---|---|
| Molecular Weight | 196.07 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 77.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 196.07356 |
| Heavy Atoms | 14 |
| Complexity | 212.0 |
Chemical Identifiers
| CAS Number | 13383-63-6 |
|---|---|
| SMILES | CC1=C(C(=C(C(=C1O)C(=O)C)O)C)O |
| InChIKey | GIMGGNBXMNVHHR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(2,4,6-Trihydroxy-3,5-dimethylphenyl)ethanone (CAS 13383-63-6), with molecular formula C10H12O4 and molecular weight 196.07 g/mol. IUPAC: 1-(2,4,6-trihydroxy-3,5-dimethylphenyl)ethanone.
Chemical Property Profile of 1-(2,4,6-Trihydroxy-3,5-dimethylphenyl)ethanone
Property Insights of 1-(2,4,6-Trihydroxy-3,5-dimethylphenyl)ethanone
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2,4,6-Trihydroxy-3,5-dimethylphenyl)ethanone. The TPSA of 77.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2,4,6-Trihydroxy-3,5-dimethylphenyl)ethanone. Following Lipinski's Rule of Five, 1-(2,4,6-Trihydroxy-3,5-dimethylphenyl)ethanone has 3 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-(2,4,6-Trihydroxy-3,5-dimethylphenyl)ethanone?
The CAS number of 1-(2,4,6-Trihydroxy-3,5-dimethylphenyl)ethanone is 13383-63-6.
What is the molecular formula of 1-(2,4,6-Trihydroxy-3,5-dimethylphenyl)ethanone?
The molecular formula of 1-(2,4,6-Trihydroxy-3,5-dimethylphenyl)ethanone is C10H12O4.
What is the molecular weight of 1-(2,4,6-Trihydroxy-3,5-dimethylphenyl)ethanone?
The molecular weight of 1-(2,4,6-Trihydroxy-3,5-dimethylphenyl)ethanone is 196.07 g/mol.
Where can I buy 1-(2,4,6-Trihydroxy-3,5-dimethylphenyl)ethanone?
You can request a quote for 1-(2,4,6-Trihydroxy-3,5-dimethylphenyl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2,4,6-Trihydroxy-3,5-dimethylphenyl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,4,6-Trihydroxy-3,5-dimethylphenyl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.