2',4'-Dimethoxy-3'-methylpropiophenone
TL;DR: 2',4'-Dimethoxy-3'-methylpropiophenone (CAS 77942-13-3) is a chemical compound with molecular formula C12H16O3 and molecular weight 208.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,4-dimethoxy-3-methylphenyl)propan-1-one
Also Known As: 2',4'-Dimethoxy-3'-methylpropiophenone, 1-(2,4-dimethoxy-3-methylphenyl)propan-1-one, 1-Propanone,1-(2,4-dimethoxy-3-methylphenyl)-, 1-(2,4-Dimethoxy-3-methylphenyl)-1-propanone, 2'',4''-DIMETHOXY-3''-METHYLPROPIOPHENONE
| Molecular Formula | C12H16O3 |
|---|---|
| Molecular Weight | 208.11 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 208.10994 |
| Heavy Atoms | 15 |
| Complexity | 215.0 |
Chemical Identifiers
| CAS Number | 77942-13-3 |
|---|---|
| SMILES | CCC(=O)C1=C(C(=C(C=C1)OC)C)OC |
| InChIKey | AEDLWPLURGCFTR-UHFFFAOYSA-N |
Product Overview
2',4'-Dimethoxy-3'-methylpropiophenone (CAS 77942-13-3), with molecular formula C12H16O3 and molecular weight 208.11 g/mol. IUPAC: 1-(2,4-dimethoxy-3-methylphenyl)propan-1-one.
Chemical Property Profile of 2',4'-Dimethoxy-3'-methylpropiophenone
Property Insights of 2',4'-Dimethoxy-3'-methylpropiophenone
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2',4'-Dimethoxy-3'-methylpropiophenone. With a topological polar surface area (TPSA) of 35.5 Ų, 2',4'-Dimethoxy-3'-methylpropiophenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2',4'-Dimethoxy-3'-methylpropiophenone 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 2',4'-Dimethoxy-3'-methylpropiophenone?
The CAS number of 2',4'-Dimethoxy-3'-methylpropiophenone is 77942-13-3.
What is the molecular formula of 2',4'-Dimethoxy-3'-methylpropiophenone?
The molecular formula of 2',4'-Dimethoxy-3'-methylpropiophenone is C12H16O3.
What is the molecular weight of 2',4'-Dimethoxy-3'-methylpropiophenone?
The molecular weight of 2',4'-Dimethoxy-3'-methylpropiophenone is 208.11 g/mol.
Where can I buy 2',4'-Dimethoxy-3'-methylpropiophenone?
You can request a quote for 2',4'-Dimethoxy-3'-methylpropiophenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2',4'-Dimethoxy-3'-methylpropiophenone?
Yes, KEHONG BIO provides custom synthesis services for 2',4'-Dimethoxy-3'-methylpropiophenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.