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Home > Bromides > 1823883-11-9
1823883-11-9 | 5-Thiazolecarboxamide, 2-bromo-4-(trifluoromethyl)-
CAS No: 1823883-11-9 Catalog No: AG0023QJ MDL No:
Product Description
Catalog Number:
AG0023QJ
Chemical Name:
5-Thiazolecarboxamide, 2-bromo-4-(trifluoromethyl)-
CAS Number:
1823883-11-9
Molecular Formula:
C5H2BrF3N2OS
Molecular Weight:
275.0464
IUPAC Name:
2-bromo-4-(trifluoromethyl)-1,3-thiazole-5-carboxamide
InChI:
InChI=1S/C5H2BrF3N2OS/c6-4-11-2(5(7,8)9)1(13-4)3(10)12/h(H2,10,12)
InChI Key:
FKDQADPRJIACOX-UHFFFAOYSA-N
SMILES:
Brc1sc(c(n1)C(F)(F)F)C(=O)N
Properties
Complexity:
224
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.902g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
275.043g/mol
Monoisotopic Mass:
273.902g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
84.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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