1-(2-Bromoethoxy)-4-tert-butylbenzene
TL;DR: 1-(2-Bromoethoxy)-4-tert-butylbenzene (CAS 5952-59-0) is a chemical compound with molecular formula C12H17BrO and molecular weight 256.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-bromoethoxy)-4-tert-butylbenzene
Also Known As: 1-(2-bromoethoxy)-4-tert-butylbenzene, 2-Bromoethyl 4-(tert-butyl)phenyl ether, 1-(2-bromoethoxy)-4-(tert-butyl)benzene, bromoethylbutylphenylether, 1- -4-TERT-BUTYLBENZENE
| Molecular Formula | C12H17BrO |
|---|---|
| Molecular Weight | 256.05 g/mol |
| LogP | 3.7578 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 256.0463 |
| Heavy Atoms | 14 |
| Complexity | 271.36835 |
Chemical Identifiers
| CAS Number | 5952-59-0 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)OCCBr |
Product Overview
1-(2-Bromoethoxy)-4-tert-butylbenzene (CAS 5952-59-0), with molecular formula C12H17BrO and molecular weight 256.05 g/mol. IUPAC: 1-(2-bromoethoxy)-4-tert-butylbenzene.
Chemical Property Profile of 1-(2-Bromoethoxy)-4-tert-butylbenzene
Property Insights of 1-(2-Bromoethoxy)-4-tert-butylbenzene
The XLogP value of 3.7578 indicates that 1-(2-Bromoethoxy)-4-tert-butylbenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.23 Ų, 1-(2-Bromoethoxy)-4-tert-butylbenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Bromoethoxy)-4-tert-butylbenzene 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
Frequently Asked Questions
What is the CAS number of 1-(2-Bromoethoxy)-4-tert-butylbenzene?
The CAS number of 1-(2-Bromoethoxy)-4-tert-butylbenzene is 5952-59-0.
What is the molecular formula of 1-(2-Bromoethoxy)-4-tert-butylbenzene?
The molecular formula of 1-(2-Bromoethoxy)-4-tert-butylbenzene is C12H17BrO.
What is the molecular weight of 1-(2-Bromoethoxy)-4-tert-butylbenzene?
The molecular weight of 1-(2-Bromoethoxy)-4-tert-butylbenzene is 256.05 g/mol.
Where can I buy 1-(2-Bromoethoxy)-4-tert-butylbenzene?
You can request a quote for 1-(2-Bromoethoxy)-4-tert-butylbenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Bromoethoxy)-4-tert-butylbenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Bromoethoxy)-4-tert-butylbenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.