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2039-96-5 | 1-Propanesulfonic acid, 3-(trimethylsilyl)-, sodium salt (1:1)
CAS No: 2039-96-5 Catalog No: AG002977 MDL No:MFCD00007537
Product Description
Catalog Number:
AG002977
Chemical Name:
1-Propanesulfonic acid, 3-(trimethylsilyl)-, sodium salt (1:1)
CAS Number:
2039-96-5
Molecular Formula:
C6H15NaO3SSi
Molecular Weight:
218.3218
MDL Number:
MFCD00007537
IUPAC Name:
sodium;3-trimethylsilylpropane-1-sulfonate
InChI:
InChI=1S/C6H16O3SSi.Na/c1-11(2,3)6-4-5-10(7,8)9;/h4-6H2,1-3H3,(H,7,8,9);/q;+1/p-1
InChI Key:
HWEXKRHYVOGVDA-UHFFFAOYSA-M
SMILES:
C[Si](CCCS(=O)(=O)[O-])(C)C.[Na+]
EC Number:
218-031-5
Properties
Complexity:
202
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.041g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
218.318g/mol
Monoisotopic Mass:
218.041g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
65.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
| Title | Journal |
|---|---|
| Measurement of absolute concentrations of individual compounds in metabolite mixtures by gradient-selective time-zero 1H-13C HSQC with two concentration references and fast maximum likelihood reconstruction analysis. | Analytical chemistry 20111215 |
| Shuttle DNP spectrometer with a two-center magnet. | Physical chemistry chemical physics : PCCP 20100614 |
| A quantitative NMR protocol for the simultaneous analysis of atropine and obidoxime in parenteral injection devices. | Journal of pharmaceutical and biomedical analysis 20090501 |
| Alzheimer's Abeta40 studied by NMR at low pH reveals that sodium 4,4-dimethyl-4-silapentane-1-sulfonate (DSS) binds and promotes beta-ball oligomerization. | The Journal of biological chemistry 20050204 |
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