2-(4-Bromophenyl)-1-(3,4-dimethoxyphenyl)ethanone
TL;DR: 2-(4-Bromophenyl)-1-(3,4-dimethoxyphenyl)ethanone (CAS 127896-26-8) is a chemical compound with molecular formula C16H15BrO3 and molecular weight 334.02045 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-bromophenyl)-1-(3,4-dimethoxyphenyl)ethanone
Also Known As: NCI60_005446, 2-(4-bromophenyl)-1-(3,4-dimethoxyphenyl)ethanone, 2-(4-Bromophenyl)-1-(3,4-dimethoxyphenyl)ethan-1-one
Technical Specifications
| Molecular Formula | C16H15BrO3 |
| Molecular Weight | 334.02045 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 334.02045 Da |
| Heavy Atoms | 20 |
| Complexity | 313.0 |
| SMILES | COC1=C(C=C(C=C1)C(=O)CC2=CC=C(C=C2)Br)OC |
| InChIKey | MXGKGYJSNIOYPZ-UHFFFAOYSA-N |
Chemical Property Profile of 2-(4-Bromophenyl)-1-(3,4-dimethoxyphenyl)ethanone
Property Insights of 2-(4-Bromophenyl)-1-(3,4-dimethoxyphenyl)ethanone
The XLogP value of 3.8 indicates that 2-(4-Bromophenyl)-1-(3,4-dimethoxyphenyl)ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, 2-(4-Bromophenyl)-1-(3,4-dimethoxyphenyl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Bromophenyl)-1-(3,4-dimethoxyphenyl)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
What is the CAS number of 2-(4-Bromophenyl)-1-(3,4-dimethoxyphenyl)ethanone?
The CAS number of 2-(4-Bromophenyl)-1-(3,4-dimethoxyphenyl)ethanone is 127896-26-8.
What is the molecular formula of 2-(4-Bromophenyl)-1-(3,4-dimethoxyphenyl)ethanone?
The molecular formula of 2-(4-Bromophenyl)-1-(3,4-dimethoxyphenyl)ethanone is C16H15BrO3.
What is the molecular weight of 2-(4-Bromophenyl)-1-(3,4-dimethoxyphenyl)ethanone?
The molecular weight of 2-(4-Bromophenyl)-1-(3,4-dimethoxyphenyl)ethanone is 334.02045 g/mol.
Where can I buy 2-(4-Bromophenyl)-1-(3,4-dimethoxyphenyl)ethanone?
You can request a quote for 2-(4-Bromophenyl)-1-(3,4-dimethoxyphenyl)ethanone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(4-Bromophenyl)-1-(3,4-dimethoxyphenyl)ethanone?
Yes, CoreyChem provides custom synthesis services for 2-(4-Bromophenyl)-1-(3,4-dimethoxyphenyl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.