硒代甜菜碱甲酯
TL;DR: 硒代甜菜碱甲酯 (CAS 102856-52-0) is a chemical compound with molecular formula COC(=O)C[Se+](C)C and molecular weight 182.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
硒代甜菜碱甲酯
(2-methoxy-2-oxoethyl)-dimethylselanium
Also Known As: Selenobetaine methyl ester, SeBMe, (2-methoxy-2-oxoethyl)-dimethylselanium, Dimethyl(methoxycarbonylmethyl)selenonium, (2-Methoxy-2-oxoethyl)di(methyl)selanium
| Molecular Formula | COC(=O)C[Se+](C)C |
|---|---|
| Molecular Weight | 182.99 g/mol |
| LogP | 0.9138 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 182.99243 |
| Heavy Atoms | 8 |
| Complexity | 80.0 |
Chemical Identifiers
| CAS Number | 102856-52-0 |
|---|---|
| SMILES | COC(=O)C[Se+](C)C |
| InChIKey | FHJDMYOCFQXWSQ-UHFFFAOYSA-N |
Product Overview
硒代甜菜碱甲酯 (CAS 102856-52-0), with molecular formula COC(=O)C[Se+](C)C and molecular weight 182.99 g/mol. IUPAC: (2-methoxy-2-oxoethyl)-dimethylselanium.
Chemical Property Profile of 硒代甜菜碱甲酯
Property Insights of 硒代甜菜碱甲酯
The XLogP value of 0.9138 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 硒代甜菜碱甲酯. With a topological polar surface area (TPSA) of 26.3 Ų, 硒代甜菜碱甲酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 硒代甜菜碱甲酯 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 硒代甜菜碱甲酯?
The CAS number of 硒代甜菜碱甲酯 is 102856-52-0.
What is the molecular formula of 硒代甜菜碱甲酯?
The molecular formula of 硒代甜菜碱甲酯 is COC(=O)C[Se+](C)C.
What is the molecular weight of 硒代甜菜碱甲酯?
The molecular weight of 硒代甜菜碱甲酯 is 182.99 g/mol.
Where can I buy 硒代甜菜碱甲酯?
You can request a quote for 硒代甜菜碱甲酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 硒代甜菜碱甲酯?
Yes, KEHONG BIO provides custom synthesis services for 硒代甜菜碱甲酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.