Home Sulfos 3-(2-phenylethenesulfonamido)propanoic acid

3-(2-phenylethenesulfonamido)propanoic acid

CAS No.:
297138-62-6
Catalog Number:
AG019I6P
Molecular Formula:
C11H13NO4S
Molecular Weight:
255.2902
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Product Description
Catalog Number:
AG019I6P
Chemical Name:
3-(2-phenylethenesulfonamido)propanoic acid
CAS Number:
297138-62-6
Molecular Formula:
C11H13NO4S
Molecular Weight:
255.2902
MDL Number:
MFCD00591256
IUPAC Name:
3-(2-phenylethenylsulfonylamino)propanoic acid
InChI:
InChI=1S/C11H13NO4S/c13-11(14)6-8-12-17(15,16)9-7-10-4-2-1-3-5-10/h1-5,7,9,12H,6,8H2,(H,13,14)
InChI Key:
KMGIOGNXCLEHQV-UHFFFAOYSA-N
SMILES:
OC(=O)CCNS(=O)(=O)C=Cc1ccccc1
Properties
Complexity:
363  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.057g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
255.288g/mol
Monoisotopic Mass:
255.057g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
91.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
0.8  
Properties