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1965304-63-5 | 4-Methyl-5-trifluoromethyl-2-(4-trifluoromethyl-phenyl)-thiazole
CAS No: 1965304-63-5 Catalog No: AG01F5WK MDL No:MFCD29904495
Product Description
Catalog Number:
AG01F5WK
Chemical Name:
4-Methyl-5-trifluoromethyl-2-(4-trifluoromethyl-phenyl)-thiazole
CAS Number:
1965304-63-5
Molecular Formula:
C12H7F6NS
Molecular Weight:
311.2461
MDL Number:
MFCD29904495
IUPAC Name:
4-methyl-5-(trifluoromethyl)-2-[4-(trifluoromethyl)phenyl]-1,3-thiazole
InChI:
InChI=1S/C12H7F6NS/c1-6-9(12(16,17)18)20-10(19-6)7-2-4-8(5-3-7)11(13,14)15/h2-5H,1H3
InChI Key:
RNCNSKZKPVMCQZ-UHFFFAOYSA-N
SMILES:
Cc1nc(sc1C(F)(F)F)c1ccc(cc1)C(F)(F)F
Properties
Complexity:
334
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
311.02g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
311.245g/mol
Monoisotopic Mass:
311.02g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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