Ethyl 2-bromooctadecanoate
TL;DR: Ethyl 2-bromooctadecanoate (CAS 5909-92-2) is a chemical compound with molecular formula C20H39BrO2 and molecular weight 390.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-bromooctadecanoate
Also Known As: ethyl 2-bromooctadecanoate, 2-bromo-octadecanoic acid ethyl ester, 2-BROMOOCTADECANOIC ACID, ETHYL ESTER
| Molecular Formula | C20H39BrO2 |
|---|---|
| Molecular Weight | 390.21 g/mol |
| LogP | 9.6 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 18 |
| Exact Mass | 390.21335 |
| Heavy Atoms | 23 |
| Complexity | 256.0 |
Chemical Identifiers
| CAS Number | 5909-92-2 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCC(C(=O)OCC)Br |
| InChIKey | XWNFINQDWGXIOT-UHFFFAOYSA-N |
Product Overview
Ethyl 2-bromooctadecanoate (CAS 5909-92-2), with molecular formula C20H39BrO2 and molecular weight 390.21 g/mol. IUPAC: ethyl 2-bromooctadecanoate.
Chemical Property Profile of Ethyl 2-bromooctadecanoate
Property Insights of Ethyl 2-bromooctadecanoate
The XLogP value of 9.6 indicates that Ethyl 2-bromooctadecanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Ethyl 2-bromooctadecanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2-bromooctadecanoate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethyl 2-bromooctadecanoate?
The CAS number of Ethyl 2-bromooctadecanoate is 5909-92-2.
What is the molecular formula of Ethyl 2-bromooctadecanoate?
The molecular formula of Ethyl 2-bromooctadecanoate is C20H39BrO2.
What is the molecular weight of Ethyl 2-bromooctadecanoate?
The molecular weight of Ethyl 2-bromooctadecanoate is 390.21 g/mol.
Where can I buy Ethyl 2-bromooctadecanoate?
You can request a quote for Ethyl 2-bromooctadecanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-bromooctadecanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-bromooctadecanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.