1-(3,4-Dimethoxy-2-methylphenyl)ethanone
TL;DR: 1-(3,4-Dimethoxy-2-methylphenyl)ethanone (CAS 6269-58-5) 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-2-methylphenyl)ethanone
Also Known As: 1-(3,4-dimethoxy-2-methylphenyl)ethanone, 1-(3,4-dimethoxy-2-methylphenyl)ethan-1-one, 2-methyl-3,4-dimethoxyacetophenone, 3',4'-Dimethoxy-2'-methylacetophenone, 1-(3,4-dimethoxy-2-methyl-phenyl)ethanone
| Molecular Formula | C11H14O3 |
|---|---|
| Molecular Weight | 194.09 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 194.0943 |
| Heavy Atoms | 14 |
| Complexity | 203.0 |
Chemical Identifiers
| CAS Number | 6269-58-5 |
|---|---|
| SMILES | CC1=C(C=CC(=C1OC)OC)C(=O)C |
| InChIKey | SKRFNWJZAZMOFB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(3,4-Dimethoxy-2-methylphenyl)ethanone (CAS 6269-58-5), with molecular formula C11H14O3 and molecular weight 194.09 g/mol. IUPAC: 1-(3,4-dimethoxy-2-methylphenyl)ethanone.
Chemical Property Profile of 1-(3,4-Dimethoxy-2-methylphenyl)ethanone
Property Insights of 1-(3,4-Dimethoxy-2-methylphenyl)ethanone
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3,4-Dimethoxy-2-methylphenyl)ethanone. With a topological polar surface area (TPSA) of 35.5 Ų, 1-(3,4-Dimethoxy-2-methylphenyl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3,4-Dimethoxy-2-methylphenyl)ethanone 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 1-(3,4-Dimethoxy-2-methylphenyl)ethanone?
The CAS number of 1-(3,4-Dimethoxy-2-methylphenyl)ethanone is 6269-58-5.
What is the molecular formula of 1-(3,4-Dimethoxy-2-methylphenyl)ethanone?
The molecular formula of 1-(3,4-Dimethoxy-2-methylphenyl)ethanone is C11H14O3.
What is the molecular weight of 1-(3,4-Dimethoxy-2-methylphenyl)ethanone?
The molecular weight of 1-(3,4-Dimethoxy-2-methylphenyl)ethanone is 194.09 g/mol.
Where can I buy 1-(3,4-Dimethoxy-2-methylphenyl)ethanone?
You can request a quote for 1-(3,4-Dimethoxy-2-methylphenyl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3,4-Dimethoxy-2-methylphenyl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,4-Dimethoxy-2-methylphenyl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.