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5471-90-9

5471-90-9 | N-(4-hydroxyphenyl)benzenesulfonamide

CAS No: 5471-90-9 Catalog No: AG019Y3V MDL No:MFCD00025018

Product Description

Catalog Number:
AG019Y3V
Chemical Name:
N-(4-hydroxyphenyl)benzenesulfonamide
CAS Number:
5471-90-9
Molecular Formula:
C12H11NO3S
Molecular Weight:
249.2856
MDL Number:
MFCD00025018
IUPAC Name:
N-(4-hydroxyphenyl)benzenesulfonamide
InChI:
InChI=1S/C12H11NO3S/c14-11-8-6-10(7-9-11)13-17(15,16)12-4-2-1-3-5-12/h1-9,13-14H
InChI Key:
WHZPMLXZOSFAKY-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)NS(=O)(=O)c1ccccc1
EC Number:
654-333-7
NSC Number:
28472

Properties

Complexity:
322  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.046g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
249.284g/mol
Monoisotopic Mass:
249.046g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
74.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  

Literature

Title Journal
N-(4-Hydroxy-phen-yl)benzene-sulfon-amide. Acta crystallographica. Section E, Structure reports online 20100501

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