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Home > Fluorides > 944903-11-1
944903-11-1 | 5-trifluoro-2-piperidin-4-ylpyrimidine
CAS No: 944903-11-1 Catalog No: AG01EZJJ MDL No:
Product Description
Catalog Number:
AG01EZJJ
Chemical Name:
5-trifluoro-2-piperidin-4-ylpyrimidine
CAS Number:
944903-11-1
Molecular Formula:
C10H12F3N3
Molecular Weight:
231.2176
IUPAC Name:
2-piperidin-4-yl-5-(trifluoromethyl)pyrimidine
InChI:
InChI=1S/C10H12F3N3/c11-10(12,13)8-5-15-9(16-6-8)7-1-3-14-4-2-7/h5-7,14H,1-4H2
InChI Key:
UADXUTYYMOWJFY-UHFFFAOYSA-N
SMILES:
FC(c1cnc(nc1)C1CCNCC1)(F)F
Properties
Complexity:
218
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.098g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
231.222g/mol
Monoisotopic Mass:
231.098g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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