Home Sulfos 2-[2-(4-methylphenyl)ethenesulfonamido]acetic acid

2-[2-(4-methylphenyl)ethenesulfonamido]acetic acid

CAS No.:
744227-34-7
Catalog Number:
AG019JEN
Molecular Formula:
C11H13NO4S
Molecular Weight:
255.2902
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Product Description
Catalog Number:
AG019JEN
Chemical Name:
2-[2-(4-methylphenyl)ethenesulfonamido]acetic acid
CAS Number:
744227-34-7
Molecular Formula:
C11H13NO4S
Molecular Weight:
255.2902
MDL Number:
MFCD05266743
IUPAC Name:
2-[2-(4-methylphenyl)ethenylsulfonylamino]acetic acid
InChI:
InChI=1S/C11H13NO4S/c1-9-2-4-10(5-3-9)6-7-17(15,16)12-8-11(13)14/h2-7,12H,8H2,1H3,(H,13,14)
InChI Key:
SXELJLLMSJFTSC-UHFFFAOYSA-N
SMILES:
OC(=O)CNS(=O)(=O)C=Cc1ccc(cc1)C
Properties
Complexity:
375  
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:
5  
Topological Polar Surface Area:
91.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
1.3  
Properties