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1416351-77-3 | 4-(4-Trifluoromethyl-piperidin-1-yl)-benzylamine
CAS No: 1416351-77-3 Catalog No: AG01F9JM MDL No:MFCD20821463
Product Description
Catalog Number:
AG01F9JM
Chemical Name:
4-(4-Trifluoromethyl-piperidin-1-yl)-benzylamine
CAS Number:
1416351-77-3
Molecular Formula:
C13H17F3N2
Molecular Weight:
258.2827
MDL Number:
MFCD20821463
IUPAC Name:
[4-[4-(trifluoromethyl)piperidin-1-yl]phenyl]methanamine
InChI:
InChI=1S/C13H17F3N2/c14-13(15,16)11-5-7-18(8-6-11)12-3-1-10(9-17)2-4-12/h1-4,11H,5-9,17H2
InChI Key:
AFLDOYDSDIMPOC-UHFFFAOYSA-N
SMILES:
NCc1ccc(cc1)N1CCC(CC1)C(F)(F)F
Properties
Complexity:
252
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.134g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
258.288g/mol
Monoisotopic Mass:
258.134g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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