7-Bromocycloocta-1,3,5-triene
TL;DR: 7-Bromocycloocta-1,3,5-triene (CAS 16327-13-2) is a chemical compound with molecular formula C8H9Br and molecular weight 183.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-bromocycloocta-1,3,5-triene
Also Known As: 7-Bromo-1,3,5-cyclooctatriene, 1,3,5-Cyclooctatriene,7-bromo-, 1,3,5-Cyclooctatriene, 7-bromo-, (1Z,3Z,5Z)-7-bromocycloocta-1,3,5-triene
| Molecular Formula | C8H9Br |
|---|---|
| Molecular Weight | 183.99 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 183.98875 |
| Heavy Atoms | 9 |
| Complexity | 154.0 |
Chemical Identifiers
| CAS Number | 16327-13-2 |
|---|---|
| SMILES | C1C=CC=CC=CC1Br |
| InChIKey | CJZXWYXQEJTDRN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
7-Bromocycloocta-1,3,5-triene (CAS 16327-13-2), with molecular formula C8H9Br and molecular weight 183.99 g/mol. IUPAC: 7-bromocycloocta-1,3,5-triene.
Chemical Property Profile of 7-Bromocycloocta-1,3,5-triene
Property Insights of 7-Bromocycloocta-1,3,5-triene
The XLogP value of 3.3 indicates that 7-Bromocycloocta-1,3,5-triene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 7-Bromocycloocta-1,3,5-triene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Bromocycloocta-1,3,5-triene has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 7-Bromocycloocta-1,3,5-triene?
The CAS number of 7-Bromocycloocta-1,3,5-triene is 16327-13-2.
What is the molecular formula of 7-Bromocycloocta-1,3,5-triene?
The molecular formula of 7-Bromocycloocta-1,3,5-triene is C8H9Br.
What is the molecular weight of 7-Bromocycloocta-1,3,5-triene?
The molecular weight of 7-Bromocycloocta-1,3,5-triene is 183.99 g/mol.
Where can I buy 7-Bromocycloocta-1,3,5-triene?
You can request a quote for 7-Bromocycloocta-1,3,5-triene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Bromocycloocta-1,3,5-triene?
Yes, KEHONG BIO provides custom synthesis services for 7-Bromocycloocta-1,3,5-triene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.