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(S)-2-(Trifluoromethyl)piperidine

CAS No.:
154727-51-2
Catalog Number:
AG00AQNN
Molecular Formula:
C6H10F3N
Molecular Weight:
153.1455
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Product Description
Catalog Number:
AG00AQNN
Chemical Name:
(S)-2-(Trifluoromethyl)piperidine
CAS Number:
154727-51-2
Molecular Formula:
C6H10F3N
Molecular Weight:
153.1455
MDL Number:
MFCD11226597
IUPAC Name:
(2S)-2-(trifluoromethyl)piperidine
InChI:
InChI=1S/C6H10F3N/c7-6(8,9)5-3-1-2-4-10-5/h5,10H,1-4H2/t5-/m0/s1
InChI Key:
NAXDEFXCCITWEU-YFKPBYRVSA-N
SMILES:
FC([C@@H]1CCCCN1)(F)F
Properties
Complexity:
110  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
153.077g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
153.148g/mol
Monoisotopic Mass:
153.077g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties