Home Sulfos 2-ethanesulfonamidopropanoic acid

2-ethanesulfonamidopropanoic acid

CAS No.:
908578-43-8
Catalog Number:
AG01EK5G
Molecular Formula:
C5H11NO4S
Molecular Weight:
181.2101
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Product Description
Catalog Number:
AG01EK5G
Chemical Name:
2-ethanesulfonamidopropanoic acid
CAS Number:
908578-43-8
Molecular Formula:
C5H11NO4S
Molecular Weight:
181.2101
MDL Number:
MFCD09048314
IUPAC Name:
2-(ethylsulfonylamino)propanoic acid
InChI:
InChI=1S/C5H11NO4S/c1-3-11(9,10)6-4(2)5(7)8/h4,6H,3H2,1-2H3,(H,7,8)
InChI Key:
GAUFCGISNUXEDT-UHFFFAOYSA-N
SMILES:
CCS(=O)(=O)NC(C(=O)O)C
Properties
Complexity:
227  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.041g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
181.206g/mol
Monoisotopic Mass:
181.041g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
91.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3  
Properties