((4-Bromobutoxy)methyl)benzene
TL;DR: ((4-Bromobutoxy)methyl)benzene (CAS 60789-54-0) is a chemical compound with molecular formula C11H15BrO and molecular weight 242.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromobutoxymethylbenzene
Also Known As: Benzyl 4-bromobutyl ether, 4-bromobutoxymethylbenzene, ((4-Bromobutoxy)methyl)benzene, 4-Benzyloxy-1-bromobutane, null
| Molecular Formula | C11H15BrO |
|---|---|
| Molecular Weight | 242.03 g/mol |
| LogP | 3.3783 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 242.03062 |
| Heavy Atoms | 13 |
| Complexity | 210.59009 |
Chemical Identifiers
| CAS Number | 60789-54-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)COCCCCBr |
Product Overview
((4-Bromobutoxy)methyl)benzene (CAS 60789-54-0), with molecular formula C11H15BrO and molecular weight 242.03 g/mol. IUPAC: 4-bromobutoxymethylbenzene.
Chemical Property Profile of ((4-Bromobutoxy)methyl)benzene
Property Insights of ((4-Bromobutoxy)methyl)benzene
The XLogP value of 3.3783 indicates that ((4-Bromobutoxy)methyl)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.23 Ų, ((4-Bromobutoxy)methyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ((4-Bromobutoxy)methyl)benzene 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 ((4-Bromobutoxy)methyl)benzene?
The CAS number of ((4-Bromobutoxy)methyl)benzene is 60789-54-0.
What is the molecular formula of ((4-Bromobutoxy)methyl)benzene?
The molecular formula of ((4-Bromobutoxy)methyl)benzene is C11H15BrO.
What is the molecular weight of ((4-Bromobutoxy)methyl)benzene?
The molecular weight of ((4-Bromobutoxy)methyl)benzene is 242.03 g/mol.
Where can I buy ((4-Bromobutoxy)methyl)benzene?
You can request a quote for ((4-Bromobutoxy)methyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ((4-Bromobutoxy)methyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for ((4-Bromobutoxy)methyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.