Home Other Building Blocks 2-(4-sulfamoylphenyl)propanoic acid

2-(4-sulfamoylphenyl)propanoic acid

CAS No.:
1565048-99-8
Catalog Number:
AG01BVI7
Molecular Formula:
C9H11NO4S
Molecular Weight:
229.2529
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Product Description
Catalog Number:
AG01BVI7
Chemical Name:
2-(4-sulfamoylphenyl)propanoic acid
CAS Number:
1565048-99-8
Molecular Formula:
C9H11NO4S
Molecular Weight:
229.2529
MDL Number:
MFCD26912284
IUPAC Name:
2-(4-sulfamoylphenyl)propanoic acid
InChI:
InChI=1S/C9H11NO4S/c1-6(9(11)12)7-2-4-8(5-3-7)15(10,13)14/h2-6H,1H3,(H,11,12)(H2,10,13,14)
InChI Key:
GTNIHNXJMUVRBM-UHFFFAOYSA-N
SMILES:
OC(=O)C(c1ccc(cc1)S(=O)(=O)N)C
Properties
Complexity:
325  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.041g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
229.25g/mol
Monoisotopic Mass:
229.041g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
106A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties