Home Sulfos 1-Propanesulfonic acid,2-methyl-2-[(1-oxo-2-propen-1-yl)amino]-, sodium salt (1:1)

1-Propanesulfonic acid,2-methyl-2-[(1-oxo-2-propen-1-yl)amino]-, sodium salt (1:1)

CAS No.:
5165-97-9
Catalog Number:
AG006UEC
Molecular Formula:
C7H12NNaO4S
Molecular Weight:
229.2293
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Product Description
Catalog Number:
AG006UEC
Chemical Name:
1-Propanesulfonic acid,2-methyl-2-[(1-oxo-2-propen-1-yl)amino]-, sodium salt (1:1)
CAS Number:
5165-97-9
Molecular Formula:
C7H12NNaO4S
Molecular Weight:
229.2293
MDL Number:
MFCD00156481
IUPAC Name:
sodium;2-methyl-2-(prop-2-enoylamino)propane-1-sulfonate
InChI:
InChI=1S/C7H13NO4S.Na/c1-4-6(9)8-7(2,3)5-13(10,11)12;/h4H,1,5H2,2-3H3,(H,8,9)(H,10,11,12);/q;+1/p-1
InChI Key:
FWFUWXVFYKCSQA-UHFFFAOYSA-M
SMILES:
C=CC(=O)NC(CS(=O)(=O)[O-])(C)C.[Na+]
EC Number:
225-948-4
UNII:
2T9Q6EKI0G
Properties
Complexity:
304  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.038g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
229.226g/mol
Monoisotopic Mass:
229.038g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
94.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties