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662111-33-3 | 2(3H)-Benzothiazolone,7-acetyl-4-hydroxy-(9CI)
CAS No: 662111-33-3 Catalog No: AG00FR0I MDL No:
Product Description
Catalog Number:
AG00FR0I
Chemical Name:
2(3H)-Benzothiazolone,7-acetyl-4-hydroxy-(9CI)
CAS Number:
662111-33-3
IUPAC Name:
7-acetyl-4-hydroxy-3H-1,3-benzothiazol-2-one
InChI:
InChI=1S/C9H7NO3S/c1-4(11)5-2-3-6(12)7-8(5)14-9(13)10-7/h2-3,12H,1H3,(H,10,13)
InChI Key:
ISRVZIVXPKWOSM-UHFFFAOYSA-N
Properties
Complexity:
281
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.015g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
209.219g/mol
Monoisotopic Mass:
209.015g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
91.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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