3-(1-Pyridinio)-1-propanesulfonate
Product Information
Molecular Formula
C8H11NO3S
Molecular Weight
201.24
Description
3-(N,N-Dimethylpalmitylammonio)propanesulfonate has been used in a study to assess the characterization of rat dihydroceramide desaturase. It has also been used in a study to investigate the inhibition of mitochondrial carnitine-acylcarnitine translocase by sulfobetaines. It is also used for extraction of proteins for analysis by chromatography, mass spectroscopy, and electrophoretic methods.
Synonyms
3-pyridin-1-ium-1-ylpropane-1-sulfonate
IUPAC Name
3-pyridin-1-ium-1-ylpropane-1-sulfonate
SMILES
C1=CC=[N+](C=C1)CCCS(=O)(=O)[O-]
InChI
InChI=1S/C8H11NO3S/c10-13(11,12)8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2
InChI Key
REEBJQTUIJTGAL-UHFFFAOYSA-N
Melting Point
280 °C
Flash Point
320 °F
Purity
> 98.0 % (LC) (N)
Appearance
White solid
Application
Used to formulate metal surface treatment products (including those for galvanizing and electroplating), non-metal surface treatment products, processing aids (i.e. pH regulators, flocculants, and precipitants), laboratory chemicals, and flux coating/core welding and soldering products.
Storage
2-8 °C
LogP
0.55470
Safety Information
Precautionary Statement
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word
Warning
QC Data
Computed Properties
XLogP3
0.1
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
3
Exact Mass
201.04596439 g/mol
Monoisotopic Mass
201.04596439 g/mol
Topological Polar Surface Area
69.5Ų
Heavy Atom Count
13
Formal Charge
0
Complexity
213
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
Patents
| Publication Number | Title | Priority Date |
|---|---|---|
| WO-2022056220-A2 | Excipient compounds for protein formulations | 2020-09-11 |
| US-2022077449-A1 | Electrochemical cells, components thereof, and methods of their manufacture | 2020-09-08 |
| WO-2022055968-A1 | Electrochemical cells, components thereof, and methods of their manufacture | 2020-09-08 |
| WO-2022040453-A1 | Blood cell lysing agent for isolating bacteria from blood culture | 2020-08-20 |
| WO-2022032087-A1 | Methods of preparing lipid nanoparticles | 2020-08-06 |
| WO-2022032153-A1 | Cell culture medium for use in producing gene therapy products in bioreactors | 2020-08-06 |
| WO-2022032154-A2 | Compositions for the delivery of payload molecules to airway epithelium | 2020-08-06 |
| WO-2021183896-A1 | Methods of modulating gastrointestinal microbial metabolic pathways and metabolites | 2020-03-13 |
| JP-2021133666-A | On-machine development type lithographic printing plate Original plate, lithographic printing plate manufacturing method, and lithographic printing method | 2020-02-28 |
| WO-2021155274-A1 | Methods of preparing lipid nanoparticles | 2020-01-31 |
Literatures
| PMID | Publication Date | Title | Journal |
|---|---|---|---|
| 17284802 | 2007-02-01 | 3-(1-Pyridinio)propanesulfonate and 3-(benzyldimethylammonio)propanesulfonate monohydrate | Acta crystallographica. Section C, Crystal structure communications |
