![1-[4-(3-Bromopropoxy)-3-methylphenyl]ethanone structure](/static/products/133/133455-25-1.webp)
1-[4-(3-Bromopropoxy)-3-methylphenyl]ethanone
TL;DR: 1-[4-(3-Bromopropoxy)-3-methylphenyl]ethanone (CAS 133455-25-1) is a chemical compound with molecular formula C12H15BrO2 and molecular weight 270.02554 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[4-(3-bromopropoxy)-3-methylphenyl]ethanone
Also Known As: 1-[4-(3-bromopropoxy)-3-methylphenyl]ethanon, 1-[4-(3-bromopropoxy)3-methylphenyl]ethanone, 1-[4-(3bromopropoxy)-3-methylphenyl]ethanone, Ethanone, 1-[4-(3-bromopropoxy)-3-methylphenyl]-, 1-[4-(3-bromopropoxy)-3- methylphenyl]ethanone
Technical Specifications
| Molecular Formula | C12H15BrO2 |
| Molecular Weight | 270.02554 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 270.02554 Da |
| Heavy Atoms | 15 |
| Complexity | 206.0 |
| SMILES | CC1=C(C=CC(=C1)C(=O)C)OCCCBr |
| InChIKey | NTHACHBLQYGXLE-UHFFFAOYSA-N |
Chemical Property Profile of 1-[4-(3-Bromopropoxy)-3-methylphenyl]ethanone
Property Insights of 1-[4-(3-Bromopropoxy)-3-methylphenyl]ethanone
The XLogP value of 3.1 indicates that 1-[4-(3-Bromopropoxy)-3-methylphenyl]ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 1-[4-(3-Bromopropoxy)-3-methylphenyl]ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[4-(3-Bromopropoxy)-3-methylphenyl]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
What is the CAS number of 1-[4-(3-Bromopropoxy)-3-methylphenyl]ethanone?
The CAS number of 1-[4-(3-Bromopropoxy)-3-methylphenyl]ethanone is 133455-25-1.
What is the molecular formula of 1-[4-(3-Bromopropoxy)-3-methylphenyl]ethanone?
The molecular formula of 1-[4-(3-Bromopropoxy)-3-methylphenyl]ethanone is C12H15BrO2.
What is the molecular weight of 1-[4-(3-Bromopropoxy)-3-methylphenyl]ethanone?
The molecular weight of 1-[4-(3-Bromopropoxy)-3-methylphenyl]ethanone is 270.02554 g/mol.
Where can I buy 1-[4-(3-Bromopropoxy)-3-methylphenyl]ethanone?
You can request a quote for 1-[4-(3-Bromopropoxy)-3-methylphenyl]ethanone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-[4-(3-Bromopropoxy)-3-methylphenyl]ethanone?
Yes, CoreyChem provides custom synthesis services for 1-[4-(3-Bromopropoxy)-3-methylphenyl]ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.