1-(3-Bromophenyl)-3-(m-tolyl)prop-2-en-1-one
TL;DR: 1-(3-Bromophenyl)-3-(m-tolyl)prop-2-en-1-one (CAS 1072796-30-5) is a chemical compound with molecular formula C16H13BrO and molecular weight 300.01498 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(3-bromophenyl)-3-(3-methylphenyl)prop-2-en-1-one
Also Known As: 1-(3-bromophenyl)-3-(3-methylphenyl)prop-2-en-1-one, 1-(3-bromophenyl)-3-(m-tolyl)prop-2-en-1-one, (2E)-1-(3-Bromophenyl)-3-(3-methylphenyl)prop-2-en-1-one
Technical Specifications
| Molecular Formula | C16H13BrO |
| Molecular Weight | 300.01498 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 300.01498 Da |
| Heavy Atoms | 18 |
| Complexity | 310.0 |
| SMILES | CC1=CC(=CC=C1)C=CC(=O)C2=CC(=CC=C2)Br |
| InChIKey | JOQHSWKNAPUEHD-UHFFFAOYSA-N |
Chemical Property Profile of 1-(3-Bromophenyl)-3-(m-tolyl)prop-2-en-1-one
Property Insights of 1-(3-Bromophenyl)-3-(m-tolyl)prop-2-en-1-one
The XLogP value of 4.1 indicates that 1-(3-Bromophenyl)-3-(m-tolyl)prop-2-en-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 1-(3-Bromophenyl)-3-(m-tolyl)prop-2-en-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-Bromophenyl)-3-(m-tolyl)prop-2-en-1-one has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-(3-Bromophenyl)-3-(m-tolyl)prop-2-en-1-one?
The CAS number of 1-(3-Bromophenyl)-3-(m-tolyl)prop-2-en-1-one is 1072796-30-5.
What is the molecular formula of 1-(3-Bromophenyl)-3-(m-tolyl)prop-2-en-1-one?
The molecular formula of 1-(3-Bromophenyl)-3-(m-tolyl)prop-2-en-1-one is C16H13BrO.
What is the molecular weight of 1-(3-Bromophenyl)-3-(m-tolyl)prop-2-en-1-one?
The molecular weight of 1-(3-Bromophenyl)-3-(m-tolyl)prop-2-en-1-one is 300.01498 g/mol.
Where can I buy 1-(3-Bromophenyl)-3-(m-tolyl)prop-2-en-1-one?
You can request a quote for 1-(3-Bromophenyl)-3-(m-tolyl)prop-2-en-1-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(3-Bromophenyl)-3-(m-tolyl)prop-2-en-1-one?
Yes, CoreyChem provides custom synthesis services for 1-(3-Bromophenyl)-3-(m-tolyl)prop-2-en-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.