1-(4-Bromobutoxy)-4-fluorobenzene
TL;DR: 1-(4-Bromobutoxy)-4-fluorobenzene (CAS 2033-80-9) is a chemical compound with molecular formula C10H12BrFO and molecular weight 246.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-bromobutoxy)-4-fluorobenzene
Also Known As: 1-(4-bromobutoxy)-4-fluorobenzene, 4-Fluorophenoxybutyl bromide, 1-Bromo-4-(4'-fluorophenoxy)butane, 6-Bromo-1,2-dihydro-naphthalene, Benzene, 1-(4-bromobutoxy)-4-fluoro-
| Molecular Formula | C10H12BrFO |
|---|---|
| Molecular Weight | 246.01 g/mol |
| LogP | 3.3796 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 246.00555 |
| Heavy Atoms | 13 |
| Complexity | 235.185 |
Chemical Identifiers
| CAS Number | 2033-80-9 |
|---|---|
| SMILES | C1=CC(=CC=C1OCCCCBr)F |
Product Overview
1-(4-Bromobutoxy)-4-fluorobenzene (CAS 2033-80-9), with molecular formula C10H12BrFO and molecular weight 246.01 g/mol. IUPAC: 1-(4-bromobutoxy)-4-fluorobenzene.
Chemical Property Profile of 1-(4-Bromobutoxy)-4-fluorobenzene
Property Insights of 1-(4-Bromobutoxy)-4-fluorobenzene
The XLogP value of 3.3796 indicates that 1-(4-Bromobutoxy)-4-fluorobenzene 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-(4-Bromobutoxy)-4-fluorobenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Bromobutoxy)-4-fluorobenzene 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-(4-Bromobutoxy)-4-fluorobenzene?
The CAS number of 1-(4-Bromobutoxy)-4-fluorobenzene is 2033-80-9.
What is the molecular formula of 1-(4-Bromobutoxy)-4-fluorobenzene?
The molecular formula of 1-(4-Bromobutoxy)-4-fluorobenzene is C10H12BrFO.
What is the molecular weight of 1-(4-Bromobutoxy)-4-fluorobenzene?
The molecular weight of 1-(4-Bromobutoxy)-4-fluorobenzene is 246.01 g/mol.
Where can I buy 1-(4-Bromobutoxy)-4-fluorobenzene?
You can request a quote for 1-(4-Bromobutoxy)-4-fluorobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Bromobutoxy)-4-fluorobenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Bromobutoxy)-4-fluorobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.