乙炔钠
TL;DR: 乙炔钠 (CAS 2881-62-1) 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.
乙炔钠
ethyl 9-bromononanoate
Also Known As: Ethyl 9-bromononanoate, Nonanoic acid, 9-bromo-, ethyl ester, Disodium acetylide, disodium ethynediide, Ethyl9-bromononanoate
| Molecular Formula | C11H21BrO2 |
|---|---|
| Molecular Weight | 264.07 g/mol |
| LogP | 3.9 |
| 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 | 2881-62-1 |
|---|---|
| SMILES | CCOC(=O)CCCCCCCCBr |
| InChIKey | KXZBPLOPBKIUTC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
乙炔钠 (CAS 2881-62-1), with molecular formula C11H21BrO2 and molecular weight 264.07 g/mol. IUPAC: ethyl 9-bromononanoate.
Chemical Property Profile of 乙炔钠
Property Insights of 乙炔钠
The XLogP value of 3.9 indicates that 乙炔钠 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 乙炔钠 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 乙炔钠 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 乙炔钠?
The CAS number of 乙炔钠 is 2881-62-1.
What is the molecular formula of 乙炔钠?
The molecular formula of 乙炔钠 is C11H21BrO2.
What is the molecular weight of 乙炔钠?
The molecular weight of 乙炔钠 is 264.07 g/mol.
Where can I buy 乙炔钠?
You can request a quote for 乙炔钠 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 乙炔钠?
Yes, KEHONG BIO provides custom synthesis services for 乙炔钠 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.