(8-Bromooctyl)benzene
TL;DR: (8-Bromooctyl)benzene (CAS 446831-28-3) 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.
8-bromooctylbenzene
Also Known As: (8-Bromooctyl)benzene, 1-Bromo-8-phenyloctane, 8-bromooctylbenzene, 1-Bromo-8-phenyl-octane, Benzene, (8-bromooctyl)-
| Molecular Formula | C14H21Br |
|---|---|
| Molecular Weight | 268.08 g/mol |
| LogP | 6.5 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 8 |
| Exact Mass | 268.08267 |
| Heavy Atoms | 15 |
| Complexity | 127.0 |
Chemical Identifiers
| CAS Number | 446831-28-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCCCCCCCBr |
| InChIKey | XGBMCFCZEKCCDJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(8-Bromooctyl)benzene (CAS 446831-28-3), with molecular formula C14H21Br and molecular weight 268.08 g/mol. IUPAC: 8-bromooctylbenzene.
Chemical Property Profile of (8-Bromooctyl)benzene
Property Insights of (8-Bromooctyl)benzene
The XLogP value of 6.5 indicates that (8-Bromooctyl)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, (8-Bromooctyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (8-Bromooctyl)benzene 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 (8-Bromooctyl)benzene?
The CAS number of (8-Bromooctyl)benzene is 446831-28-3.
What is the molecular formula of (8-Bromooctyl)benzene?
The molecular formula of (8-Bromooctyl)benzene is C14H21Br.
What is the molecular weight of (8-Bromooctyl)benzene?
The molecular weight of (8-Bromooctyl)benzene is 268.08 g/mol.
Where can I buy (8-Bromooctyl)benzene?
You can request a quote for (8-Bromooctyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (8-Bromooctyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for (8-Bromooctyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.