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Home > Fluorides > 914636-85-4
914636-85-4 | {1-[4-(trifluoromethyl)pyrimidin-2-yl]piperidin-4-yl}methanol
CAS No: 914636-85-4 Catalog No: AG01F6KK MDL No:
Product Description
Catalog Number:
AG01F6KK
Chemical Name:
{1-[4-(trifluoromethyl)pyrimidin-2-yl]piperidin-4-yl}methanol
CAS Number:
914636-85-4
Molecular Formula:
C11H14F3N3O
Molecular Weight:
261.2436
IUPAC Name:
[1-[4-(trifluoromethyl)pyrimidin-2-yl]piperidin-4-yl]methanol
InChI:
InChI=1S/C11H14F3N3O/c12-11(13,14)9-1-4-15-10(16-9)17-5-2-8(7-18)3-6-17/h1,4,8,18H,2-3,5-7H2
InChI Key:
MUGMOWSJXRECDC-UHFFFAOYSA-N
SMILES:
OCC1CCN(CC1)c1nccc(n1)C(F)(F)F
Properties
Complexity:
267
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.109g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
261.248g/mol
Monoisotopic Mass:
261.109g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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