3,4-Dimethoxyphenyl methyl ketone
TL;DR: 3,4-Dimethoxyphenyl methyl ketone (CAS 1131-62-0) is a chemical compound with molecular formula C10H12O3 and molecular weight 180.07864 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(3,4-dimethoxyphenyl)ethanone
Also Known As: Acetoveratrone, 3',4'-Dimethoxyacetophenone, 1-(3,4-Dimethoxyphenyl)ethanone, 3,4-DIMETHOXYACETOPHENONE, 4-Acetylveratrole
Application Areas
Top 5 of 19 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C10H12O3 |
| Molecular Weight | 180.07864 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 180.07864 Da |
| Heavy Atoms | 13 |
| Complexity | 179.0 |
| SMILES | CC(=O)C1=CC(=C(C=C1)OC)OC |
| InChIKey | IQZLUWLMQNGTIW-UHFFFAOYSA-N |
Chemical Property Profile of 3,4-Dimethoxyphenyl methyl ketone
Property Insights of 3,4-Dimethoxyphenyl methyl ketone
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-Dimethoxyphenyl methyl ketone. With a topological polar surface area (TPSA) of 35.5 Ų, 3,4-Dimethoxyphenyl methyl ketone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-Dimethoxyphenyl methyl ketone 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
What is the CAS number of 3,4-Dimethoxyphenyl methyl ketone?
The CAS number of 3,4-Dimethoxyphenyl methyl ketone is 1131-62-0.
What is the molecular formula of 3,4-Dimethoxyphenyl methyl ketone?
The molecular formula of 3,4-Dimethoxyphenyl methyl ketone is C10H12O3.
What is the molecular weight of 3,4-Dimethoxyphenyl methyl ketone?
The molecular weight of 3,4-Dimethoxyphenyl methyl ketone is 180.07864 g/mol.
Where can I buy 3,4-Dimethoxyphenyl methyl ketone?
You can request a quote for 3,4-Dimethoxyphenyl methyl ketone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3,4-Dimethoxyphenyl methyl ketone?
Yes, CoreyChem provides custom synthesis services for 3,4-Dimethoxyphenyl methyl ketone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.