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Home > Fluorides > 141492-95-7
141492-95-7 | 1-Azabicyclo[2.2.2]octan-3-ol, 3-[6-(trifluoromethyl)-2-pyrazinyl]-
CAS No: 141492-95-7 Catalog No: AG001GGJ MDL No:
Product Description
Catalog Number:
AG001GGJ
Chemical Name:
1-Azabicyclo[2.2.2]octan-3-ol, 3-[6-(trifluoromethyl)-2-pyrazinyl]-
CAS Number:
141492-95-7
Molecular Formula:
C12H14F3N3O
Molecular Weight:
273.2543
IUPAC Name:
3-[6-(trifluoromethyl)pyrazin-2-yl]-1-azabicyclo[2.2.2]octan-3-ol
InChI:
InChI=1S/C12H14F3N3O/c13-12(14,15)10-6-16-5-9(17-10)11(19)7-18-3-1-8(11)2-4-18/h5-6,8,19H,1-4,7H2
InChI Key:
GLLUEWUZEOPFFH-UHFFFAOYSA-N
SMILES:
FC(c1cncc(n1)C1(O)CN2CCC1CC2)(F)F
Properties
Complexity:
344
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.109g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
273.259g/mol
Monoisotopic Mass:
273.109g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
49.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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