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1221171-88-5 | 2-Pyridinamine, 5-(trifluoromethoxy)-
CAS No: 1221171-88-5 Catalog No: AG0016RV MDL No:MFCD19690149
Product Description
Catalog Number:
AG0016RV
Chemical Name:
2-Pyridinamine, 5-(trifluoromethoxy)-
CAS Number:
1221171-88-5
Molecular Formula:
C6H5F3N2O
Molecular Weight:
178.1119
MDL Number:
MFCD19690149
IUPAC Name:
5-(trifluoromethoxy)pyridin-2-amine
InChI:
InChI=1S/C6H5F3N2O/c7-6(8,9)12-4-1-2-5(10)11-3-4/h1-3H,(H2,10,11)
InChI Key:
HCYQWUCBICRJGO-UHFFFAOYSA-N
SMILES:
Nc1ccc(cn1)OC(F)(F)F
Properties
Complexity:
150
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.035g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
178.114g/mol
Monoisotopic Mass:
178.035g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
48.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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