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Home > Fluorides > 1217978-01-2
1217978-01-2 | Piperidine, 3-(4-fluorophenyl)-, (3S)-
CAS No: 1217978-01-2 Catalog No: AG00161N MDL No:
Product Description
Catalog Number:
AG00161N
Chemical Name:
Piperidine, 3-(4-fluorophenyl)-, (3S)-
CAS Number:
1217978-01-2
Molecular Formula:
C11H14FN
Molecular Weight:
179.2340
IUPAC Name:
(3S)-3-(4-fluorophenyl)piperidine
InChI:
InChI=1S/C11H14FN/c12-11-5-3-9(4-6-11)10-2-1-7-13-8-10/h3-6,10,13H,1-2,7-8H2/t10-/m1/s1
InChI Key:
NKQDGXBXNNRWPR-SNVBAGLBSA-N
SMILES:
Fc1ccc(cc1)[C@@H]1CCCNC1
Properties
Complexity:
152
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
179.111g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
179.238g/mol
Monoisotopic Mass:
179.111g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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