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1228543-12-1 | Piperidine, 2-(4-methylphenyl)-, (2S)-
CAS No: 1228543-12-1 Catalog No: AG000JLC MDL No:
Product Description
Catalog Number:
AG000JLC
Chemical Name:
Piperidine, 2-(4-methylphenyl)-, (2S)-
CAS Number:
1228543-12-1
Molecular Formula:
C12H17N
Molecular Weight:
175.2701
IUPAC Name:
(2S)-2-(4-methylphenyl)piperidine
InChI:
InChI=1S/C12H17N/c1-10-5-7-11(8-6-10)12-4-2-3-9-13-12/h5-8,12-13H,2-4,9H2,1H3/t12-/m0/s1
InChI Key:
RPMPQNRTPBUGIW-LBPRGKRZSA-N
SMILES:
Cc1ccc(cc1)[C@@H]1CCCCN1
Properties
Complexity:
147
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
175.136g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
175.275g/mol
Monoisotopic Mass:
175.136g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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