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441771-44-4 | 7(4H)-Benzothiazolone,5,6-dihydro-2-methoxy-(9CI)
CAS No: 441771-44-4 Catalog No: AG00DWG4 MDL No:
Product Description
Catalog Number:
AG00DWG4
Chemical Name:
7(4H)-Benzothiazolone,5,6-dihydro-2-methoxy-(9CI)
CAS Number:
441771-44-4
IUPAC Name:
2-methoxy-5,6-dihydro-4H-1,3-benzothiazol-7-one
InChI:
InChI=1S/C8H9NO2S/c1-11-8-9-5-3-2-4-6(10)7(5)12-8/h2-4H2,1H3
InChI Key:
QPKMRSBMMJJWBA-UHFFFAOYSA-N
Properties
Complexity:
198
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.035g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
183.225g/mol
Monoisotopic Mass:
183.035g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
67.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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