Home Halogens Thiazole, 5-(bromomethyl)-4-methyl-2-[4-(trifluoromethyl)phenyl]-

Thiazole, 5-(bromomethyl)-4-methyl-2-[4-(trifluoromethyl)phenyl]-

CAS No.:
439134-78-8
Catalog Number:
AG00I8DA
Molecular Formula:
C12H9BrF3NS
Molecular Weight:
336.1708
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Product Description
Catalog Number:
AG00I8DA
Chemical Name:
Thiazole, 5-(bromomethyl)-4-methyl-2-[4-(trifluoromethyl)phenyl]-
CAS Number:
439134-78-8
Molecular Formula:
C12H9BrF3NS
Molecular Weight:
336.1708
MDL Number:
MFCD04115403
IUPAC Name:
5-(bromomethyl)-4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazole
InChI:
InChI=1S/C12H9BrF3NS/c1-7-10(6-13)18-11(17-7)8-2-4-9(5-3-8)12(14,15)16/h2-5H,6H2,1H3
InChI Key:
IBJHFQRRDNHDBG-UHFFFAOYSA-N
SMILES:
BrCc1sc(nc1C)c1ccc(cc1)C(F)(F)F
Properties
Complexity:
279  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
334.959g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
336.17g/mol
Monoisotopic Mass:
334.959g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5  
Properties