1-(2-Methoxy-4,5-dimethylphenyl)ethanone
TL;DR: 1-(2-Methoxy-4,5-dimethylphenyl)ethanone (CAS 91970-29-5) is a chemical compound with molecular formula C11H14O2 and molecular weight 178.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-methoxy-4,5-dimethylphenyl)ethanone
Also Known As: 4,5-Dimethyl-2-methoxyacetophenone, 1-(2-methoxy-4,5-dimethylphenyl)ethanone, 4-pent-4-enoxyphenol, 4',5'-Dimethyl-2'-methoxyacetophenone, 2-[(4-ethenylphenyl)methoxy]ethanol
| Molecular Formula | C11H14O2 |
|---|---|
| Molecular Weight | 178.10 g/mol |
| LogP | 2.51464 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 178.09938 |
| Heavy Atoms | 13 |
| Complexity | 340.18866 |
Chemical Identifiers
| CAS Number | 91970-29-5 |
|---|---|
| SMILES | CC1=CC(=C(C=C1C)OC)C(=O)C |
Product Overview
1-(2-Methoxy-4,5-dimethylphenyl)ethanone (CAS 91970-29-5), with molecular formula C11H14O2 and molecular weight 178.10 g/mol. IUPAC: 1-(2-methoxy-4,5-dimethylphenyl)ethanone.
Chemical Property Profile of 1-(2-Methoxy-4,5-dimethylphenyl)ethanone
Property Insights of 1-(2-Methoxy-4,5-dimethylphenyl)ethanone
The XLogP value of 2.51464 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Methoxy-4,5-dimethylphenyl)ethanone. With a topological polar surface area (TPSA) of 26.3 Ų, 1-(2-Methoxy-4,5-dimethylphenyl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Methoxy-4,5-dimethylphenyl)ethanone has 0 hydrogen bond donor(s) and 2 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-Methoxy-4,5-dimethylphenyl)ethanone?
The CAS number of 1-(2-Methoxy-4,5-dimethylphenyl)ethanone is 91970-29-5.
What is the molecular formula of 1-(2-Methoxy-4,5-dimethylphenyl)ethanone?
The molecular formula of 1-(2-Methoxy-4,5-dimethylphenyl)ethanone is C11H14O2.
What is the molecular weight of 1-(2-Methoxy-4,5-dimethylphenyl)ethanone?
The molecular weight of 1-(2-Methoxy-4,5-dimethylphenyl)ethanone is 178.10 g/mol.
Where can I buy 1-(2-Methoxy-4,5-dimethylphenyl)ethanone?
You can request a quote for 1-(2-Methoxy-4,5-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-Methoxy-4,5-dimethylphenyl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Methoxy-4,5-dimethylphenyl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.