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26749-57-5 | Ketone, 4-methoxy-2-methyl-7-benzothiazolyl methyl (8CI)
CAS No: 26749-57-5 Catalog No: AG00BUU5 MDL No:
Product Description
Catalog Number:
AG00BUU5
Chemical Name:
Ketone, 4-methoxy-2-methyl-7-benzothiazolyl methyl (8CI)
CAS Number:
26749-57-5
IUPAC Name:
1-(4-methoxy-2-methyl-1,3-benzothiazol-7-yl)ethanone
InChI:
InChI=1S/C11H11NO2S/c1-6(13)8-4-5-9(14-3)10-11(8)15-7(2)12-10/h4-5H,1-3H3
InChI Key:
WYPJQJIBEJYIMQ-UHFFFAOYSA-N
Properties
Complexity:
259
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.051g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
221.274g/mol
Monoisotopic Mass:
221.051g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
67.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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