p-Bromophenyloctane
TL;DR: p-Bromophenyloctane (CAS 51554-93-9) is a chemical compound with molecular formula C14H21Br and molecular weight 268.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-bromo-4-octylbenzene
Also Known As: 1-Bromo-4-octylbenzene, 1-(4-Bromophenyl)octane, p-Octylbromobenzene, 1-Bromo-4-n-octylbenzene, p-Bromophenyloctane
| Molecular Formula | C14H21Br |
|---|---|
| Molecular Weight | 268.08 g/mol |
| LogP | 6.4 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 7 |
| Exact Mass | 268.08267 |
| Heavy Atoms | 15 |
| Complexity | 136.0 |
Chemical Identifiers
| CAS Number | 51554-93-9 |
|---|---|
| SMILES | CCCCCCCCC1=CC=C(C=C1)Br |
| InChIKey | OOZQSVXPBCINJF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
p-Bromophenyloctane (CAS 51554-93-9), with molecular formula C14H21Br and molecular weight 268.08 g/mol. IUPAC: 1-bromo-4-octylbenzene.
Chemical Property Profile of p-Bromophenyloctane
Property Insights of p-Bromophenyloctane
The XLogP value of 6.4 indicates that p-Bromophenyloctane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, p-Bromophenyloctane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, p-Bromophenyloctane 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 p-Bromophenyloctane?
The CAS number of p-Bromophenyloctane is 51554-93-9.
What is the molecular formula of p-Bromophenyloctane?
The molecular formula of p-Bromophenyloctane is C14H21Br.
What is the molecular weight of p-Bromophenyloctane?
The molecular weight of p-Bromophenyloctane is 268.08 g/mol.
Where can I buy p-Bromophenyloctane?
You can request a quote for p-Bromophenyloctane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for p-Bromophenyloctane?
Yes, KEHONG BIO provides custom synthesis services for p-Bromophenyloctane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.