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137929-12-5 | Thiazole, 2-phenyl-4-(trifluoromethyl)-
CAS No: 137929-12-5 Catalog No: AG00144T MDL No:
Product Description
Catalog Number:
AG00144T
Chemical Name:
Thiazole, 2-phenyl-4-(trifluoromethyl)-
CAS Number:
137929-12-5
Molecular Formula:
C10H6F3NS
Molecular Weight:
229.2215
IUPAC Name:
2-phenyl-4-(trifluoromethyl)-1,3-thiazole
InChI:
InChI=1S/C10H6F3NS/c11-10(12,13)8-6-15-9(14-8)7-4-2-1-3-5-7/h1-6H
InChI Key:
RUGWSEFITJJGAI-UHFFFAOYSA-N
SMILES:
FC(c1csc(n1)c1ccccc1)(F)F
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.017g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
229.22g/mol
Monoisotopic Mass:
229.017g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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