1-(4-Bromobutoxy)-3-chlorobenzene
TL;DR: 1-(4-Bromobutoxy)-3-chlorobenzene (CAS 23529-80-8) is a chemical compound with molecular formula C10H12BrClO and molecular weight 261.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-bromobutoxy)-3-chlorobenzene
Also Known As: 1-(4-bromobutoxy)-3-chlorobenzene, 3-Chlorophenoxybutylbromide, 1- -3-CHLOROBENZENE, m-(4-bromobutoxy)chlorobenzene, 4-(2-CHLOROETHOXY)-5-METHOXY-2-NITROBENZALDEHYDE
| Molecular Formula | C10H12BrClO |
|---|---|
| Molecular Weight | 261.98 g/mol |
| LogP | 3.8939 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 261.976 |
| Heavy Atoms | 13 |
| Complexity | 252.435 |
Chemical Identifiers
| CAS Number | 23529-80-8 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Cl)OCCCCBr |
Product Overview
1-(4-Bromobutoxy)-3-chlorobenzene (CAS 23529-80-8), with molecular formula C10H12BrClO and molecular weight 261.98 g/mol. IUPAC: 1-(4-bromobutoxy)-3-chlorobenzene.
Chemical Property Profile of 1-(4-Bromobutoxy)-3-chlorobenzene
Property Insights of 1-(4-Bromobutoxy)-3-chlorobenzene
The XLogP value of 3.8939 indicates that 1-(4-Bromobutoxy)-3-chlorobenzene 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)-3-chlorobenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Bromobutoxy)-3-chlorobenzene 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)-3-chlorobenzene?
The CAS number of 1-(4-Bromobutoxy)-3-chlorobenzene is 23529-80-8.
What is the molecular formula of 1-(4-Bromobutoxy)-3-chlorobenzene?
The molecular formula of 1-(4-Bromobutoxy)-3-chlorobenzene is C10H12BrClO.
What is the molecular weight of 1-(4-Bromobutoxy)-3-chlorobenzene?
The molecular weight of 1-(4-Bromobutoxy)-3-chlorobenzene is 261.98 g/mol.
Where can I buy 1-(4-Bromobutoxy)-3-chlorobenzene?
You can request a quote for 1-(4-Bromobutoxy)-3-chlorobenzene 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)-3-chlorobenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Bromobutoxy)-3-chlorobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.