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26749-58-6 | Ketone, 4-hydroxy-2-methyl-5-benzothiazolyl methyl (8CI)
CAS No: 26749-58-6 Catalog No: AG00BUU6 MDL No:
Product Description
Catalog Number:
AG00BUU6
Chemical Name:
Ketone, 4-hydroxy-2-methyl-5-benzothiazolyl methyl (8CI)
CAS Number:
26749-58-6
IUPAC Name:
1-(4-hydroxy-2-methyl-1,3-benzothiazol-5-yl)ethanone
InChI:
InChI=1S/C10H9NO2S/c1-5(12)7-3-4-8-9(10(7)13)11-6(2)14-8/h3-4,13H,1-2H3
InChI Key:
RPQCILXGTYUUFP-UHFFFAOYSA-N
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.035g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
207.247g/mol
Monoisotopic Mass:
207.035g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
78.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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