3-ALLYLOXY-2-HYDROXY-1-PROPANESULFONIC ACID, SODIUM SALT

Product Information

Molecular Formula:
C6H11NaO5S
Molecular Weight:
218.2
Description
3-ALLYLOXY-2-HYDROXY-1-PROPANESULFONIC ACID, SODIUM SALT is used as a pharmaceutical ingredient in the biopharmaceutical industry to develop drugs for the treatment of various diseases such as hypertension and cardiovascular disease.
Synonyms
SPAE; SODIUM 1-ALLYLOXY-2-HYDROXYPROPYLSULFONATE; 1-Propanesulfonicacid,2-hydroxy-3-(2-propenyloxy)-,monosodiumsalt; 2-hydroxy-3-(2-propenyloxy)-1-propanesulfonicacimonosodiumsalt; 3-ALLYLOXY-2-HYDROXY-1-PROPANE, SODIUM SALT; 3-ALLYLOXY-2-HYDROXY-1-PROPANESUL
IUPAC Name
sodium2-hydroxy-3-prop-2-enoxypropane-1-sulfonate
Canonical SMILES
C=CCOCC(CS(=O)(=O)[O-])O.[Na+]
InChI
InChI=1S/C6H12O5S.Na/c1-2-3-11-4-6(7)5-12(8,9)10/h2,6-7H,1,3-5H2,(H,8,9,10)/q+1/p-1
InChI Key
CJGJYOBXQLCLRG-UHFFFAOYSA-M
Flash Point
Not applicable
Density
1.17
Refractive Index
n20/D 1.394

Safety Information

Hazards
H318 - H361f
Precautionary Statement
P201 - P280 - P305 + P351 + P338 + P310 - P308 + P313

Computed Properties

Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
5
Rotatable Bond Count
6
Exact Mass
218.02248890 g/mol
Monoisotopic Mass
218.02248890 g/mol
Topological Polar Surface Area
95Ų
Heavy Atom Count
13
Formal Charge
0
Complexity
220
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
1
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
2
Compound Is Canonicalized
Yes

Patents

Publication Number Title Priority Date
WO-2021103473-A1 Shrinkage-reducing polycarboxylic acid water reducing agent and preparation method thereof 2019-11-25
US-2021062064-A1 High temperature treatment fluid with nanocellulose 2018-11-19
EP-3748747-A1 Binder composition for electrode of secondary battery, and electrode mixture 2018-11-07
US-2020411872-A1 Electrode Binder Composition for Secondary Battery Electrode and Electrode Mixture Including the Same 2018-11-07
WO-2019172365-A1 (meth)acrylic acid copolymer-containing composition and method for producing (meth)acrylic acid copolymer 2018-03-08
EP-3763786-A1 (meth)acrylic acid copolymer-containing composition and method for producing (meth)acrylic acid copolymer 2018-03-08
US-2021009739-A1 (meth)acrylic acid copolymer-containing composition and method for producing (meth)acrylic acid copolymer 2018-03-08
US-10377849-B2 Ionic and electronic conducting binder for electrochemical devices 2017-11-13
US-2019144600-A1 Ionic and Electronic Conducting Binder for Electrochemical Devices 2017-11-13
EP-3546491-A1 Carboxyl-group-containing copolymer, and method for producing same 2016-11-28
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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