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Home > Amines > 1221171-94-3

1221171-94-3

1221171-94-3 | 3-Pyridinamine, 2-(trifluoromethoxy)-

CAS No: 1221171-94-3 Catalog No: AG0016RR MDL No:MFCD19690148

Product Description

Catalog Number:
AG0016RR
Chemical Name:
3-Pyridinamine, 2-(trifluoromethoxy)-
CAS Number:
1221171-94-3
Molecular Formula:
C6H5F3N2O
Molecular Weight:
178.1119
MDL Number:
MFCD19690148
IUPAC Name:
2-(trifluoromethoxy)pyridin-3-amine
InChI:
InChI=1S/C6H5F3N2O/c7-6(8,9)12-5-4(10)2-1-3-11-5/h1-3H,10H2
InChI Key:
CUEOPNNIXGYENY-UHFFFAOYSA-N
SMILES:
Nc1cccnc1OC(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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