Home Sulfos 2-(4-chlorobenzenesulfonamido)-3-hydroxybutanoic acid

2-(4-chlorobenzenesulfonamido)-3-hydroxybutanoic acid

CAS No.:
1396962-58-5
Catalog Number:
AG019HPT
Molecular Formula:
C10H12ClNO5S
Molecular Weight:
293.7240
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Product Description
Catalog Number:
AG019HPT
Chemical Name:
2-(4-chlorobenzenesulfonamido)-3-hydroxybutanoic acid
CAS Number:
1396962-58-5
Molecular Formula:
C10H12ClNO5S
Molecular Weight:
293.7240
MDL Number:
MFCD03948303
IUPAC Name:
2-[(4-chlorophenyl)sulfonylamino]-3-hydroxybutanoic acid
InChI:
InChI=1S/C10H12ClNO5S/c1-6(13)9(10(14)15)12-18(16,17)8-4-2-7(11)3-5-8/h2-6,9,12-13H,1H3,(H,14,15)
InChI Key:
PQRYZRJKXCNTKT-UHFFFAOYSA-N
SMILES:
CC(C(C(=O)O)NS(=O)(=O)c1ccc(cc1)Cl)O
Properties
Complexity:
386  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.012g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
293.718g/mol
Monoisotopic Mass:
293.012g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
112A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties