Home Other Building Blocks 3-[3-(trifluoromethyl)phenyl]piperidine

3-[3-(trifluoromethyl)phenyl]piperidine

CAS No.:
64321-45-5
Catalog Number:
AG01BA2O
Molecular Formula:
C12H14F3N
Molecular Weight:
229.2415
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Product Description
Catalog Number:
AG01BA2O
Chemical Name:
3-[3-(trifluoromethyl)phenyl]piperidine
CAS Number:
64321-45-5
Molecular Formula:
C12H14F3N
Molecular Weight:
229.2415
MDL Number:
MFCD11047439
IUPAC Name:
3-[3-(trifluoromethyl)phenyl]piperidine
InChI:
InChI=1S/C12H14F3N/c13-12(14,15)11-5-1-3-9(7-11)10-4-2-6-16-8-10/h1,3,5,7,10,16H,2,4,6,8H2
InChI Key:
NAAXALWMZKHEHY-UHFFFAOYSA-N
SMILES:
FC(c1cccc(c1)C1CCCNC1)(F)F
Properties
Complexity:
227  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.108g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
229.246g/mol
Monoisotopic Mass:
229.108g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties