2-Octene,1-bromo-3-methyl-, (z)-(9ci)
TL;DR: 2-Octene,1-bromo-3-methyl-, (z)-(9ci) (CAS 53369-62-3) is a chemical compound with molecular formula C9H17Br and molecular weight 204.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-bromo-3-methyloct-2-ene
Also Known As: 1-bromo-3-methyloct-2-ene, 2-Octene,1-bromo-3-methyl-, (z)-(9ci)
| Molecular Formula | C9H17Br |
|---|---|
| Molecular Weight | 204.05 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 5 |
| Exact Mass | 204.05136 |
| Heavy Atoms | 10 |
| Complexity | 94.0 |
Chemical Identifiers
| CAS Number | 53369-62-3 |
|---|---|
| SMILES | CCCCCC(=CCBr)C |
| InChIKey | FABPEHHINRPZGV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Octene,1-bromo-3-methyl-, (z)-(9ci) (CAS 53369-62-3), with molecular formula C9H17Br and molecular weight 204.05 g/mol. IUPAC: 1-bromo-3-methyloct-2-ene.
Chemical Property Profile of 2-Octene,1-bromo-3-methyl-, (z)-(9ci)
Property Insights of 2-Octene,1-bromo-3-methyl-, (z)-(9ci)
The XLogP value of 4.5 indicates that 2-Octene,1-bromo-3-methyl-, (z)-(9ci) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 2-Octene,1-bromo-3-methyl-, (z)-(9ci) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Octene,1-bromo-3-methyl-, (z)-(9ci) 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 2-Octene,1-bromo-3-methyl-, (z)-(9ci)?
The CAS number of 2-Octene,1-bromo-3-methyl-, (z)-(9ci) is 53369-62-3.
What is the molecular formula of 2-Octene,1-bromo-3-methyl-, (z)-(9ci)?
The molecular formula of 2-Octene,1-bromo-3-methyl-, (z)-(9ci) is C9H17Br.
What is the molecular weight of 2-Octene,1-bromo-3-methyl-, (z)-(9ci)?
The molecular weight of 2-Octene,1-bromo-3-methyl-, (z)-(9ci) is 204.05 g/mol.
Where can I buy 2-Octene,1-bromo-3-methyl-, (z)-(9ci)?
You can request a quote for 2-Octene,1-bromo-3-methyl-, (z)-(9ci) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Octene,1-bromo-3-methyl-, (z)-(9ci)?
Yes, KEHONG BIO provides custom synthesis services for 2-Octene,1-bromo-3-methyl-, (z)-(9ci) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.