((2-Carboxyethoxy)methyl)dimethylsulphonium bromide
TL;DR: ((2-Carboxyethoxy)methyl)dimethylsulphonium bromide (CAS 94023-71-9) is a chemical compound with molecular formula C6H13BrO3S and molecular weight 243.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-carboxyethoxymethyl(dimethyl)sulfanium bromide
Also Known As: EINECS 301-669-4, ((2-Carboxyethoxy)methyl)dimethylsulphonium bromide, [(2-Carboxyethoxy)methyl]dimethylsulfonium bromide, 2-carboxyethyloxymethyl(dimethyl)sulfanium bromide, [(2-CARBOXYETHOXY)METHYL]DIMETHYLSULPHONIUM BROMIDE
| Molecular Formula | C6H13BrO3S |
|---|---|
| Molecular Weight | 243.98 g/mol |
| LogP | -2.6829 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 243.97688 |
| Heavy Atoms | 11 |
| Complexity | 108.00052 |
Chemical Identifiers
| CAS Number | 94023-71-9 |
|---|---|
| SMILES | C[S+](C)COCCC(=O)O.[Br-] |
Product Overview
((2-Carboxyethoxy)methyl)dimethylsulphonium bromide (CAS 94023-71-9), with molecular formula C6H13BrO3S and molecular weight 243.98 g/mol. IUPAC: 2-carboxyethoxymethyl(dimethyl)sulfanium bromide.
Chemical Property Profile of ((2-Carboxyethoxy)methyl)dimethylsulphonium bromide
Property Insights of ((2-Carboxyethoxy)methyl)dimethylsulphonium bromide
The XLogP value of -2.6829 indicates that ((2-Carboxyethoxy)methyl)dimethylsulphonium bromide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 46.53 Ų, ((2-Carboxyethoxy)methyl)dimethylsulphonium bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ((2-Carboxyethoxy)methyl)dimethylsulphonium bromide has 1 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 ((2-Carboxyethoxy)methyl)dimethylsulphonium bromide?
The CAS number of ((2-Carboxyethoxy)methyl)dimethylsulphonium bromide is 94023-71-9.
What is the molecular formula of ((2-Carboxyethoxy)methyl)dimethylsulphonium bromide?
The molecular formula of ((2-Carboxyethoxy)methyl)dimethylsulphonium bromide is C6H13BrO3S.
What is the molecular weight of ((2-Carboxyethoxy)methyl)dimethylsulphonium bromide?
The molecular weight of ((2-Carboxyethoxy)methyl)dimethylsulphonium bromide is 243.98 g/mol.
Where can I buy ((2-Carboxyethoxy)methyl)dimethylsulphonium bromide?
You can request a quote for ((2-Carboxyethoxy)methyl)dimethylsulphonium bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ((2-Carboxyethoxy)methyl)dimethylsulphonium bromide?
Yes, KEHONG BIO provides custom synthesis services for ((2-Carboxyethoxy)methyl)dimethylsulphonium bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.