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115045-83-5 | 2(3H)-Benzothiazolone,5-hydroxy-(9CI)
CAS No: 115045-83-5 Catalog No: AG009PB1 MDL No:
Product Description
Catalog Number:
AG009PB1
Chemical Name:
2(3H)-Benzothiazolone,5-hydroxy-(9CI)
CAS Number:
115045-83-5
IUPAC Name:
5-hydroxy-3H-1,3-benzothiazol-2-one
InChI:
InChI=1S/C7H5NO2S/c9-4-1-2-6-5(3-4)8-7(10)11-6/h1-3,9H,(H,8,10)
InChI Key:
DGUTYSVRJFTBEW-UHFFFAOYSA-N
Properties
Complexity:
185
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.004g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
167.182g/mol
Monoisotopic Mass:
167.004g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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