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Home > Fluorides > 824431-97-2
824431-97-2 | 1H-Imidazole, 4-iodo-2-methyl-1-(2,2,2-trifluoroethyl)-
CAS No: 824431-97-2 Catalog No: AG004VZO MDL No:
Product Description
Catalog Number:
AG004VZO
Chemical Name:
1H-Imidazole, 4-iodo-2-methyl-1-(2,2,2-trifluoroethyl)-
CAS Number:
824431-97-2
Molecular Formula:
C6H6F3IN2
Molecular Weight:
290.0249
IUPAC Name:
4-iodo-2-methyl-1-(2,2,2-trifluoroethyl)imidazole
InChI:
InChI=1S/C6H6F3IN2/c1-4-11-5(10)2-12(4)3-6(7,8)9/h2H,3H2,1H3
InChI Key:
GGSVXDGOBFDIRX-UHFFFAOYSA-N
SMILES:
FC(Cn1cc(nc1C)I)(F)F
Properties
Complexity:
161
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.953g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
290.028g/mol
Monoisotopic Mass:
289.953g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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