Home Other Building Blocks 1-(1-Benzylpiperidin-3-yl)-2,2,2-trifluoro-ethanone

1-(1-Benzylpiperidin-3-yl)-2,2,2-trifluoro-ethanone

CAS No.:
1182349-49-0
Catalog Number:
AG008U6B
Molecular Formula:
C14H16F3NO
Molecular Weight:
271.2781
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Product Description
Catalog Number:
AG008U6B
Chemical Name:
1-(1-Benzylpiperidin-3-yl)-2,2,2-trifluoro-ethanone
CAS Number:
1182349-49-0
Molecular Formula:
C14H16F3NO
Molecular Weight:
271.2781
MDL Number:
MFCD18909669
IUPAC Name:
1-(1-benzylpiperidin-3-yl)-2,2,2-trifluoroethanone
InChI:
InChI=1S/C14H16F3NO/c15-14(16,17)13(19)12-7-4-8-18(10-12)9-11-5-2-1-3-6-11/h1-3,5-6,12H,4,7-10H2
InChI Key:
GAYNMYZCQZOPDY-UHFFFAOYSA-N
SMILES:
O=C(C(F)(F)F)C1CCCN(C1)Cc1ccccc1
Properties
Complexity:
310  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.118g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
271.283g/mol
Monoisotopic Mass:
271.118g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties