4-Bromobutylcyclooctatetraene
TL;DR: 4-Bromobutylcyclooctatetraene (CAS 55538-75-5) is a chemical compound with molecular formula C12H15Br and molecular weight 238.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromobutylcyclooctatetraene
Also Known As: 4-bromobutylcyclooctatetraene, 1-(4-Bromobutyl)-1,3,5,7-cyclooctatetraene, 1-(4-bromobutyl)cycloocta-1,3,5,7-tetraene
| Molecular Formula | C12H15Br |
|---|---|
| Molecular Weight | 238.04 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 4 |
| Exact Mass | 238.0357 |
| Heavy Atoms | 13 |
| Complexity | 224.0 |
Chemical Identifiers
| CAS Number | 55538-75-5 |
|---|---|
| SMILES | C1=CC=CC(=CC=C1)CCCCBr |
| InChIKey | HRKPIHIBFOZXNH-UHFFFAOYSA-N |
Product Overview
4-Bromobutylcyclooctatetraene (CAS 55538-75-5), with molecular formula C12H15Br and molecular weight 238.04 g/mol. IUPAC: 4-bromobutylcyclooctatetraene.
Chemical Property Profile of 4-Bromobutylcyclooctatetraene
Property Insights of 4-Bromobutylcyclooctatetraene
The XLogP value of 4.4 indicates that 4-Bromobutylcyclooctatetraene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 4-Bromobutylcyclooctatetraene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Bromobutylcyclooctatetraene has 0 hydrogen bond donor(s) and 0 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-Bromobutylcyclooctatetraene?
The CAS number of 4-Bromobutylcyclooctatetraene is 55538-75-5.
What is the molecular formula of 4-Bromobutylcyclooctatetraene?
The molecular formula of 4-Bromobutylcyclooctatetraene is C12H15Br.
What is the molecular weight of 4-Bromobutylcyclooctatetraene?
The molecular weight of 4-Bromobutylcyclooctatetraene is 238.04 g/mol.
Where can I buy 4-Bromobutylcyclooctatetraene?
You can request a quote for 4-Bromobutylcyclooctatetraene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Bromobutylcyclooctatetraene?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromobutylcyclooctatetraene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.