Home Sulfos 2-(4-acetylbenzenesulfonamido)acetic acid

2-(4-acetylbenzenesulfonamido)acetic acid

CAS No.:
749920-47-6
Catalog Number:
AG019JMO
Molecular Formula:
C10H11NO5S
Molecular Weight:
257.2630
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Product Description
Catalog Number:
AG019JMO
Chemical Name:
2-(4-acetylbenzenesulfonamido)acetic acid
CAS Number:
749920-47-6
Molecular Formula:
C10H11NO5S
Molecular Weight:
257.2630
MDL Number:
MFCD06337011
IUPAC Name:
2-[(4-acetylphenyl)sulfonylamino]acetic acid
InChI:
InChI=1S/C10H11NO5S/c1-7(12)8-2-4-9(5-3-8)17(15,16)11-6-10(13)14/h2-5,11H,6H2,1H3,(H,13,14)
InChI Key:
LBUSREIZWCQXBJ-UHFFFAOYSA-N
SMILES:
OC(=O)CNS(=O)(=O)c1ccc(cc1)C(=O)C
Properties
Complexity:
389  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.036g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
257.26g/mol
Monoisotopic Mass:
257.036g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  
Properties