1-Bromo-2-hexylbenzene
TL;DR: 1-Bromo-2-hexylbenzene (CAS 38409-58-4) is a chemical compound with molecular formula C12H17Br and molecular weight 240.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-bromo-2-hexylbenzene
Also Known As: 1-Bromo-2-hexylbenzene, 1-Bromo-2-n-hexylbenzene, 1-Hexyl-2-bromobenzene, 1-Bromo-2-hexylbenzene #, Benzene, 1-bromo-2-hexyl-
| Molecular Formula | C12H17Br |
|---|---|
| Molecular Weight | 240.05 g/mol |
| LogP | 5.6 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 5 |
| Exact Mass | 240.05136 |
| Heavy Atoms | 13 |
| Complexity | 122.0 |
Chemical Identifiers
| CAS Number | 38409-58-4 |
|---|---|
| SMILES | CCCCCCC1=CC=CC=C1Br |
| InChIKey | XKYWOQMOQMYGGL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Bromo-2-hexylbenzene (CAS 38409-58-4), with molecular formula C12H17Br and molecular weight 240.05 g/mol. IUPAC: 1-bromo-2-hexylbenzene.
Chemical Property Profile of 1-Bromo-2-hexylbenzene
Property Insights of 1-Bromo-2-hexylbenzene
The XLogP value of 5.6 indicates that 1-Bromo-2-hexylbenzene 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-Bromo-2-hexylbenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Bromo-2-hexylbenzene 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-Bromo-2-hexylbenzene?
The CAS number of 1-Bromo-2-hexylbenzene is 38409-58-4.
What is the molecular formula of 1-Bromo-2-hexylbenzene?
The molecular formula of 1-Bromo-2-hexylbenzene is C12H17Br.
What is the molecular weight of 1-Bromo-2-hexylbenzene?
The molecular weight of 1-Bromo-2-hexylbenzene is 240.05 g/mol.
Where can I buy 1-Bromo-2-hexylbenzene?
You can request a quote for 1-Bromo-2-hexylbenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Bromo-2-hexylbenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Bromo-2-hexylbenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.