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Home > Bromides > 1000339-73-0
1000339-73-0 | Thiazole, 5-(bromomethyl)-2-methyl-4-(trifluoromethyl)-
CAS No: 1000339-73-0 Catalog No: AG0000DF MDL No:MFCD09264554
Product Description
Catalog Number:
AG0000DF
Chemical Name:
Thiazole, 5-(bromomethyl)-2-methyl-4-(trifluoromethyl)-
CAS Number:
1000339-73-0
Molecular Formula:
C6H5BrF3NS
Molecular Weight:
260.0748
MDL Number:
MFCD09264554
IUPAC Name:
5-(bromomethyl)-2-methyl-4-(trifluoromethyl)-1,3-thiazole
InChI:
InChI=1S/C6H5BrF3NS/c1-3-11-5(6(8,9)10)4(2-7)12-3/h2H2,1H3
InChI Key:
OYDQGPCAYKWSAU-UHFFFAOYSA-N
SMILES:
BrCc1sc(nc1C(F)(F)F)C
Properties
Complexity:
163
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.928g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
260.072g/mol
Monoisotopic Mass:
258.928g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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