![1-(4-Bromophenyl)-4-pentylbicyclo[2.2.2]octane structure](/static/products/7692/76921-48-7.webp)
1-(4-Bromophenyl)-4-pentylbicyclo[2.2.2]octane
TL;DR: 1-(4-Bromophenyl)-4-pentylbicyclo[2.2.2]octane (CAS 76921-48-7) is a chemical compound with molecular formula C19H27Br and molecular weight 334.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-bromophenyl)-4-pentylbicyclo[2.2.2]octane
Also Known As: 1-(4-bromophenyl)-4-pentylbicyclo[2.2.2]octane, BAS 00333313, 1-(4-Bromo-phenyl)-4-pentyl-bicyclo[2.2.2]octane, 4-(4-bromophenyl)-1-pentylbicyclo[2.2.2]octane
| Molecular Formula | C19H27Br |
|---|---|
| Molecular Weight | 334.13 g/mol |
| LogP | 6.6214 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 5 |
| Exact Mass | 334.1296 |
| Heavy Atoms | 20 |
| Complexity | 420.80966 |
Chemical Identifiers
| CAS Number | 76921-48-7 |
|---|---|
| SMILES | CCCCCC12CCC(CC1)(CC2)C3=CC=C(C=C3)Br |
Product Overview
1-(4-Bromophenyl)-4-pentylbicyclo[2.2.2]octane (CAS 76921-48-7), with molecular formula C19H27Br and molecular weight 334.13 g/mol. IUPAC: 1-(4-bromophenyl)-4-pentylbicyclo[2.2.2]octane.
Chemical Property Profile of 1-(4-Bromophenyl)-4-pentylbicyclo[2.2.2]octane
Property Insights of 1-(4-Bromophenyl)-4-pentylbicyclo[2.2.2]octane
The XLogP value of 6.6214 indicates that 1-(4-Bromophenyl)-4-pentylbicyclo[2.2.2]octane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1-(4-Bromophenyl)-4-pentylbicyclo[2.2.2]octane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Bromophenyl)-4-pentylbicyclo[2.2.2]octane has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(4-Bromophenyl)-4-pentylbicyclo[2.2.2]octane?
The CAS number of 1-(4-Bromophenyl)-4-pentylbicyclo[2.2.2]octane is 76921-48-7.
What is the molecular formula of 1-(4-Bromophenyl)-4-pentylbicyclo[2.2.2]octane?
The molecular formula of 1-(4-Bromophenyl)-4-pentylbicyclo[2.2.2]octane is C19H27Br.
What is the molecular weight of 1-(4-Bromophenyl)-4-pentylbicyclo[2.2.2]octane?
The molecular weight of 1-(4-Bromophenyl)-4-pentylbicyclo[2.2.2]octane is 334.13 g/mol.
Where can I buy 1-(4-Bromophenyl)-4-pentylbicyclo[2.2.2]octane?
You can request a quote for 1-(4-Bromophenyl)-4-pentylbicyclo[2.2.2]octane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Bromophenyl)-4-pentylbicyclo[2.2.2]octane?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Bromophenyl)-4-pentylbicyclo[2.2.2]octane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.