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Sodium β-Styrenesulfonate

CAT: 0024-sc-474321Size: 5 gDry Ice: NoHazardous: No
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CAT#:0024-sc-474321Size:5 g
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CAS Number
2039-44-3

Chemical Information

Sodium 2-phenylethylene-1-sulphonate
CAS Number2039-44-3
PubChem CID23678061
IUPAC Namesodium (E)-2-phenylethenesulfonate
Molecular FormulaC8H7NaO3S
Molecular Weight206.20
Topological Polar Surface Area65.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count13
Formal Charge0
Complexity247
SMILES
C1=CC=C(C=C1)/C=C/S(=O)(=O)[O-].[Na+]
InChI
InChI=1S/C8H8O3S.Na/c9-12(10,11)7-6-8-4-2-1-3-5-8;/h1-7H,(H,9,10,11);/q;+1/p-1/b7-6+;
InChIKey
MNCGMVDMOKPCSQ-UHDJGPCESA-M
Chemical Structure
2D Structure
2D structure of Sodium 2-phenylethylene-1-sulphonate
CAS: 2039-44-3
CID: 23678061
Formula: C8H7NaO3S
MW: 206.20
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight206.20
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass206.00135954
Monoisotopic Mass206.00135954
Topological Polar Surface Area65.6 Ų
Heavy Atom Count13
Formal Charge0
Complexity247
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
OR1078451-01Sodium beta-Styrenesulfonate
CAA03944Sodium 2-Styrenesulfonate
RG-A261847-01Sodium poly (styrenesulfonate) (discontinued)
P6580-01Poly (sodium 4-styrenesulfonate)
OR350344-01Sodium p-styrenesulfonate Hydrate
RG-A261784-01Poly (sodium 4-styrenesulfonate) (discontinued)
HY-W739372B-01Poly (sodium 4-styrenesulfonate) (MW 1000000)
HY-W739372A-01Poly (sodium 4-styrenesulfonate) (MW 70000)
455-88-6Lithium-p-styrenesulfonate
OR1014684-01Poly (2,3-dihydrothieno-1,4-dioxin) -poly (styrenesulfonate)

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