Ethanone, 1-(3,4-dimethoxy-5-methylphenyl)-
TL;DR: Ethanone, 1-(3,4-dimethoxy-5-methylphenyl)- (CAS 80547-76-8) is a chemical compound with molecular formula C11H14O3 and molecular weight 194.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,4-dimethoxy-5-methylphenyl)ethanone
Also Known As: Ethanone, 1-(3,4-dimethoxy-5-methylphenyl)-, 1-(3,4-dimethoxy-5-methylphenyl)ethanone, 1-(3,4-dimethoxy-5-methylphenyl)ethan-1-one, 3-methyl-4,5-dimethoxyacetophenone, 1-(3,4-dimethoxy-5-methyl-phenyl)ethanone
| Molecular Formula | C11H14O3 |
|---|---|
| Molecular Weight | 194.09 g/mol |
| LogP | 2.21482 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 194.0943 |
| Heavy Atoms | 14 |
| Complexity | 355.79544 |
Chemical Identifiers
| CAS Number | 80547-76-8 |
|---|---|
| SMILES | CC1=CC(=CC(=C1OC)OC)C(=O)C |
Product Overview
Ethanone, 1-(3,4-dimethoxy-5-methylphenyl)- (CAS 80547-76-8), with molecular formula C11H14O3 and molecular weight 194.09 g/mol. IUPAC: 1-(3,4-dimethoxy-5-methylphenyl)ethanone.
Chemical Property Profile of Ethanone, 1-(3,4-dimethoxy-5-methylphenyl)-
Property Insights of Ethanone, 1-(3,4-dimethoxy-5-methylphenyl)-
The XLogP value of 2.21482 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanone, 1-(3,4-dimethoxy-5-methylphenyl)-. With a topological polar surface area (TPSA) of 35.53 Ų, Ethanone, 1-(3,4-dimethoxy-5-methylphenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanone, 1-(3,4-dimethoxy-5-methylphenyl)- has 0 hydrogen bond donor(s) and 3 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 Ethanone, 1-(3,4-dimethoxy-5-methylphenyl)-?
The CAS number of Ethanone, 1-(3,4-dimethoxy-5-methylphenyl)- is 80547-76-8.
What is the molecular formula of Ethanone, 1-(3,4-dimethoxy-5-methylphenyl)-?
The molecular formula of Ethanone, 1-(3,4-dimethoxy-5-methylphenyl)- is C11H14O3.
What is the molecular weight of Ethanone, 1-(3,4-dimethoxy-5-methylphenyl)-?
The molecular weight of Ethanone, 1-(3,4-dimethoxy-5-methylphenyl)- is 194.09 g/mol.
Where can I buy Ethanone, 1-(3,4-dimethoxy-5-methylphenyl)-?
You can request a quote for Ethanone, 1-(3,4-dimethoxy-5-methylphenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanone, 1-(3,4-dimethoxy-5-methylphenyl)-?
Yes, KEHONG BIO provides custom synthesis services for Ethanone, 1-(3,4-dimethoxy-5-methylphenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.