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827025-44-5 | 1H-Benzimidazol-2-amine, 5-chloro-6-(trifluoromethyl)-
CAS No: 827025-44-5 Catalog No: AG004WFY MDL No:
Product Description
Catalog Number:
AG004WFY
Chemical Name:
1H-Benzimidazol-2-amine, 5-chloro-6-(trifluoromethyl)-
CAS Number:
827025-44-5
Molecular Formula:
C8H5ClF3N3
Molecular Weight:
235.5936
IUPAC Name:
5-chloro-6-(trifluoromethyl)-1H-benzimidazol-2-amine
InChI:
InChI=1S/C8H5ClF3N3/c9-4-2-6-5(14-7(13)15-6)1-3(4)8(10,11)12/h1-2H,(H3,13,14,15)
InChI Key:
RHQVXKAXGZQSNV-UHFFFAOYSA-N
SMILES:
Clc1cc2nc([nH]c2cc1C(F)(F)F)N
Properties
Complexity:
248
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.012g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
235.594g/mol
Monoisotopic Mass:
235.012g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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