(2-乙氧基-2-氧代乙基)二甲基溴化锍
TL;DR: (2-乙氧基-2-氧代乙基)二甲基溴化锍 (CAS 5187-82-6) is a chemical compound with molecular formula C6H13BrO2S and molecular weight 227.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-乙氧基-2-氧代乙基)二甲基溴化锍
(2-ethoxy-2-oxoethyl)-dimethylsulfanium bromide
Also Known As: (Ethoxycarbonylmethyl)dimethylsulfonium bromide, Sulfonium, bromide, (2-ethoxy-2-oxoethyl)dimethylsulfonium bromide, Carbethoxymethyl-dimethylsulfonium bromide, DIMETHYLSULFONIUMBROMIDE
| Molecular Formula | C6H13BrO2S |
|---|---|
| Molecular Weight | 227.98 g/mol |
| LogP | -2.57 |
| Topological Polar Surface Area | 27.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 227.98196 |
| Heavy Atoms | 10 |
| Complexity | 91.0 |
Chemical Identifiers
| CAS Number | 5187-82-6 |
|---|---|
| SMILES | CCOC(=O)C[S+](C)C.[Br-] |
| InChIKey | JXFPTJYKYKVENJ-UHFFFAOYSA-M |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(2-乙氧基-2-氧代乙基)二甲基溴化锍 (CAS 5187-82-6), with molecular formula C6H13BrO2S and molecular weight 227.98 g/mol. IUPAC: (2-ethoxy-2-oxoethyl)-dimethylsulfanium bromide.
Chemical Property Profile of (2-乙氧基-2-氧代乙基)二甲基溴化锍
Property Insights of (2-乙氧基-2-氧代乙基)二甲基溴化锍
The XLogP value of -2.57 indicates that (2-乙氧基-2-氧代乙基)二甲基溴化锍 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 27.3 Ų, (2-乙氧基-2-氧代乙基)二甲基溴化锍 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2-乙氧基-2-氧代乙基)二甲基溴化锍 has 0 hydrogen bond donor(s) and 3 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-乙氧基-2-氧代乙基)二甲基溴化锍?
The CAS number of (2-乙氧基-2-氧代乙基)二甲基溴化锍 is 5187-82-6.
What is the molecular formula of (2-乙氧基-2-氧代乙基)二甲基溴化锍?
The molecular formula of (2-乙氧基-2-氧代乙基)二甲基溴化锍 is C6H13BrO2S.
What is the molecular weight of (2-乙氧基-2-氧代乙基)二甲基溴化锍?
The molecular weight of (2-乙氧基-2-氧代乙基)二甲基溴化锍 is 227.98 g/mol.
Where can I buy (2-乙氧基-2-氧代乙基)二甲基溴化锍?
You can request a quote for (2-乙氧基-2-氧代乙基)二甲基溴化锍 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-乙氧基-2-氧代乙基)二甲基溴化锍?
Yes, KEHONG BIO provides custom synthesis services for (2-乙氧基-2-氧代乙基)二甲基溴化锍 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.