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112923-15-6

112923-15-6 | 2-(Benzothiazol-2-ylthio)propionic acid sodium salt

CAS No: 112923-15-6 Catalog No: AG009KO9 MDL No:

Product Description

Catalog Number:
AG009KO9
Chemical Name:
2-(Benzothiazol-2-ylthio)propionic acid sodium salt
CAS Number:
112923-15-6
IUPAC Name:
sodium;2-(1,3-benzothiazol-2-ylsulfanyl)propanoate
InChI:
InChI=1S/C10H9NO2S2.Na/c1-6(9(12)13)14-10-11-7-4-2-3-5-8(7)15-10;/h2-6H,1H3,(H,12,13);/q;+1/p-1
InChI Key:
AIVMOVWBJVLIIX-UHFFFAOYSA-M

Properties

Complexity:
255  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.989g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
261.289g/mol
Monoisotopic Mass:
260.989g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
107A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0

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