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108966-48-9

108966-48-9 | 4-[(2-HYDROXYETHYL)THIO]BENZENESULFONAMIDE

CAS No: 108966-48-9 Catalog No: AG007TST MDL No:

Product Description

Catalog Number:
AG007TST
Chemical Name:
4-[(2-HYDROXYETHYL)THIO]BENZENESULFONAMIDE
CAS Number:
108966-48-9
Molecular Formula:
C8H11NO3S2
Molecular Weight:
233.3078
IUPAC Name:
4-(2-hydroxyethylsulfanyl)benzenesulfonamide
InChI:
InChI=1S/C8H11NO3S2/c9-14(11,12)8-3-1-7(2-4-8)13-6-5-10/h1-4,10H,5-6H2,(H2,9,11,12)
InChI Key:
LTXDVFFEVZJDGT-UHFFFAOYSA-N
SMILES:
OCCSc1ccc(cc1)S(=O)(=O)N

Properties

Complexity:
252  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.018g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
233.3g/mol
Monoisotopic Mass:
233.018g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
114A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  

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