Nonyl bromoacetate
TL;DR: Nonyl bromoacetate (CAS 60438-51-9) is a chemical compound with molecular formula C11H21BrO2 and molecular weight 264.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
nonyl 2-bromoacetate
Also Known As: Nonyl bromoacetate, nonyl 2-bromoacetate, Acetic acid, 2-bromo-,nonyl ester, RefChem:365891
| Molecular Formula | C11H21BrO2 |
|---|---|
| Molecular Weight | 264.07 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 10 |
| Exact Mass | 264.07248 |
| Heavy Atoms | 14 |
| Complexity | 137.0 |
Chemical Identifiers
| CAS Number | 60438-51-9 |
|---|---|
| SMILES | CCCCCCCCCOC(=O)CBr |
| InChIKey | CTAPFXJABKRLIA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Nonyl bromoacetate (CAS 60438-51-9), with molecular formula C11H21BrO2 and molecular weight 264.07 g/mol. IUPAC: nonyl 2-bromoacetate.
Chemical Property Profile of Nonyl bromoacetate
Property Insights of Nonyl bromoacetate
The XLogP value of 4.7 indicates that Nonyl bromoacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Nonyl bromoacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Nonyl bromoacetate has 0 hydrogen bond donor(s) and 2 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 Nonyl bromoacetate?
The CAS number of Nonyl bromoacetate is 60438-51-9.
What is the molecular formula of Nonyl bromoacetate?
The molecular formula of Nonyl bromoacetate is C11H21BrO2.
What is the molecular weight of Nonyl bromoacetate?
The molecular weight of Nonyl bromoacetate is 264.07 g/mol.
Where can I buy Nonyl bromoacetate?
You can request a quote for Nonyl bromoacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nonyl bromoacetate?
Yes, KEHONG BIO provides custom synthesis services for Nonyl bromoacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.