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179113-65-6 | 2-(3,5-Difluorobenzoyl)thiazole
CAS No: 179113-65-6 Catalog No: AG01FEXX MDL No:
Product Description
Catalog Number:
AG01FEXX
Chemical Name:
2-(3,5-Difluorobenzoyl)thiazole
CAS Number:
179113-65-6
Molecular Formula:
C10H5F2NOS
Molecular Weight:
225.2146
IUPAC Name:
(3,5-difluorophenyl)-(1,3-thiazol-2-yl)methanone
InChI:
InChI=1S/C10H5F2NOS/c11-7-3-6(4-8(12)5-7)9(14)10-13-1-2-15-10/h1-5H
InChI Key:
QQKPHUJQJGXVPD-UHFFFAOYSA-N
SMILES:
Fc1cc(F)cc(c1)C(=O)c1nccs1
Properties
Complexity:
242
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.006g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
225.213g/mol
Monoisotopic Mass:
225.006g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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