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86695-28-5

86695-28-5 | 2-Benzothiazolesulfonamide, 5-hydroxy-

CAS No: 86695-28-5 Catalog No: AG004O6C MDL No:

Product Description

Catalog Number:
AG004O6C
Chemical Name:
2-Benzothiazolesulfonamide, 5-hydroxy-
CAS Number:
86695-28-5
Molecular Formula:
C7H6N2O3S2
Molecular Weight:
230.2641
IUPAC Name:
5-hydroxy-1,3-benzothiazole-2-sulfonamide
InChI:
InChI=1S/C7H6N2O3S2/c8-14(11,12)7-9-5-3-4(10)1-2-6(5)13-7/h1-3,10H,(H2,8,11,12)
InChI Key:
ZOAXTOPVRCPOQX-UHFFFAOYSA-N
SMILES:
Oc1ccc2c(c1)nc(s2)S(=O)(=O)N

Properties

Complexity:
313  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.982g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
230.256g/mol
Monoisotopic Mass:
229.982g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
130A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  

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