1-(2-Bromoethoxy)-3-ethylbenzene
TL;DR: 1-(2-Bromoethoxy)-3-ethylbenzene (CAS 125797-09-3) is a chemical compound with molecular formula C10H13BrO and molecular weight 228.01498 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2-bromoethoxy)-3-ethylbenzene
Also Known As: 1-(2-bromoethoxy)-3-ethylbenzene, Benzene, 1-(2-bromoethoxy)-3-ethyl-, 1-(2-bromoethoxy)-3-ethyl-benzene, 1-{3-[4-(2-ethylbutyl)phenoxy]propoxy}-2-methylbenzene, 999-335-1
Technical Specifications
| Molecular Formula | C10H13BrO |
| Molecular Weight | 228.01498 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 228.01498 Da |
| Heavy Atoms | 12 |
| Complexity | 116.0 |
| SMILES | CCC1=CC(=CC=C1)OCCBr |
| InChIKey | MMUVKYKAWRDETJ-UHFFFAOYSA-N |
Chemical Property Profile of 1-(2-Bromoethoxy)-3-ethylbenzene
Property Insights of 1-(2-Bromoethoxy)-3-ethylbenzene
The XLogP value of 3.4 indicates that 1-(2-Bromoethoxy)-3-ethylbenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, 1-(2-Bromoethoxy)-3-ethylbenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Bromoethoxy)-3-ethylbenzene 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-(2-Bromoethoxy)-3-ethylbenzene?
The CAS number of 1-(2-Bromoethoxy)-3-ethylbenzene is 125797-09-3.
What is the molecular formula of 1-(2-Bromoethoxy)-3-ethylbenzene?
The molecular formula of 1-(2-Bromoethoxy)-3-ethylbenzene is C10H13BrO.
What is the molecular weight of 1-(2-Bromoethoxy)-3-ethylbenzene?
The molecular weight of 1-(2-Bromoethoxy)-3-ethylbenzene is 228.01498 g/mol.
Where can I buy 1-(2-Bromoethoxy)-3-ethylbenzene?
You can request a quote for 1-(2-Bromoethoxy)-3-ethylbenzene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(2-Bromoethoxy)-3-ethylbenzene?
Yes, CoreyChem provides custom synthesis services for 1-(2-Bromoethoxy)-3-ethylbenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.