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42445-47-6 | 4-(4-(METHYLTHIO)PHENYL)THIAZOL-2-OL
CAS No: 42445-47-6 Catalog No: AG00CHXG MDL No:
Product Description
Catalog Number:
AG00CHXG
Chemical Name:
4-(4-(METHYLTHIO)PHENYL)THIAZOL-2-OL
CAS Number:
42445-47-6
IUPAC Name:
4-(4-methylsulfanylphenyl)-3H-1,3-thiazol-2-one
InChI:
InChI=1S/C10H9NOS2/c1-13-8-4-2-7(3-5-8)9-6-14-10(12)11-9/h2-6H,1H3,(H,11,12)
InChI Key:
SZDBQEQTVAZKTM-UHFFFAOYSA-N
Properties
Complexity:
257
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.013g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
223.308g/mol
Monoisotopic Mass:
223.013g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
79.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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