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1239462-10-2 | 4-Pyridinamine, 5-iodo-2-(trifluoromethyl)-
CAS No: 1239462-10-2 Catalog No: AG000L96 MDL No:
Product Description
Catalog Number:
AG000L96
Chemical Name:
4-Pyridinamine, 5-iodo-2-(trifluoromethyl)-
CAS Number:
1239462-10-2
Molecular Formula:
C6H4F3IN2
Molecular Weight:
288.0090
IUPAC Name:
5-iodo-2-(trifluoromethyl)pyridin-4-amine
InChI:
InChI=1S/C6H4F3IN2/c7-6(8,9)5-1-4(11)3(10)2-12-5/h1-2H,(H2,11,12)
InChI Key:
BOCNOBUKLSOYER-UHFFFAOYSA-N
SMILES:
Ic1cnc(cc1N)C(F)(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:
287.937g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
288.012g/mol
Monoisotopic Mass:
287.937g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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