Home Sulfos 2-(4-acetamidobenzenesulfonamido)propanoic acid

2-(4-acetamidobenzenesulfonamido)propanoic acid

CAS No.:
87661-70-9
Catalog Number:
AG019JAL
Molecular Formula:
C11H14N2O5S
Molecular Weight:
286.3043
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Product Description
Catalog Number:
AG019JAL
Chemical Name:
2-(4-acetamidobenzenesulfonamido)propanoic acid
CAS Number:
87661-70-9
Molecular Formula:
C11H14N2O5S
Molecular Weight:
286.3043
MDL Number:
MFCD00431977
IUPAC Name:
2-[(4-acetamidophenyl)sulfonylamino]propanoic acid
InChI:
InChI=1S/C11H14N2O5S/c1-7(11(15)16)13-19(17,18)10-5-3-9(4-6-10)12-8(2)14/h3-7,13H,1-2H3,(H,12,14)(H,15,16)
InChI Key:
MICBDQHPLNZBLY-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1ccc(cc1)S(=O)(=O)NC(C(=O)O)C
Properties
Complexity:
435  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.062g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
286.302g/mol
Monoisotopic Mass:
286.062g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
121A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Properties