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Home > Fluorides > 901273-41-4
901273-41-4 | 3-[6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]piperidine
CAS No: 901273-41-4 Catalog No: AG019M8D MDL No:MFCD08166723
Product Description
Catalog Number:
AG019M8D
Chemical Name:
3-[6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]piperidine
CAS Number:
901273-41-4
Molecular Formula:
C12H13F3N4
Molecular Weight:
270.2536
MDL Number:
MFCD08166723
IUPAC Name:
3-piperidin-3-yl-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine
InChI:
InChI=1S/C12H13F3N4/c13-12(14,15)9-3-4-10-17-18-11(19(10)7-9)8-2-1-5-16-6-8/h3-4,7-8,16H,1-2,5-6H2
InChI Key:
XBMLMPXUXMNGQE-UHFFFAOYSA-N
SMILES:
FC(c1ccc2n(c1)c(nn2)C1CCCNC1)(F)F
Properties
Complexity:
323
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.109g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
270.259g/mol
Monoisotopic Mass:
270.109g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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