(6-Bromohexyl)benzene
TL;DR: (6-Bromohexyl)benzene (CAS 5345-05-1) 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.
6-bromohexylbenzene
Also Known As: (6-Bromohexyl)benzene, 1-Bromo-6-phenylhexane, 6-bromohexylbenzene, 6-Phenylhexyl bromide, Benzene, (6-bromohexyl)-
| Molecular Formula | C12H17Br |
|---|---|
| Molecular Weight | 240.05 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 6 |
| Exact Mass | 240.05136 |
| Heavy Atoms | 13 |
| Complexity | 106.0 |
Chemical Identifiers
| CAS Number | 5345-05-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCCCCCBr |
| InChIKey | RAOLIGFNQJMMKW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(6-Bromohexyl)benzene (CAS 5345-05-1), with molecular formula C12H17Br and molecular weight 240.05 g/mol. IUPAC: 6-bromohexylbenzene.
Chemical Property Profile of (6-Bromohexyl)benzene
Property Insights of (6-Bromohexyl)benzene
The XLogP value of 5.3 indicates that (6-Bromohexyl)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, (6-Bromohexyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (6-Bromohexyl)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 (6-Bromohexyl)benzene?
The CAS number of (6-Bromohexyl)benzene is 5345-05-1.
What is the molecular formula of (6-Bromohexyl)benzene?
The molecular formula of (6-Bromohexyl)benzene is C12H17Br.
What is the molecular weight of (6-Bromohexyl)benzene?
The molecular weight of (6-Bromohexyl)benzene is 240.05 g/mol.
Where can I buy (6-Bromohexyl)benzene?
You can request a quote for (6-Bromohexyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (6-Bromohexyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for (6-Bromohexyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.