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109300-04-1 | 7(4H)-Benzothiazolone, 5,6-dihydro-5,5-diMethyl-2-phenyl-
CAS No: 109300-04-1 Catalog No: AG009TMW MDL No:
Product Description
Catalog Number:
AG009TMW
Chemical Name:
7(4H)-Benzothiazolone, 5,6-dihydro-5,5-diMethyl-2-phenyl-
CAS Number:
109300-04-1
IUPAC Name:
5,5-dimethyl-2-phenyl-4,6-dihydro-1,3-benzothiazol-7-one
InChI:
InChI=1S/C15H15NOS/c1-15(2)8-11-13(12(17)9-15)18-14(16-11)10-6-4-3-5-7-10/h3-7H,8-9H2,1-2H3
InChI Key:
KWGWZWVUVJIYCG-UHFFFAOYSA-N
Properties
Complexity:
335
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.087g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
257.351g/mol
Monoisotopic Mass:
257.087g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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