Sign In Join Free

Products Information

4-(BOC-AMINO)-PIPERIDINE
4-(BOC-AMINO)-PIPERIDINE ID: CHH15556
CAS:73874-95-0
Supplier:ChemiK Co.,Ltd.

Get a quote


SMILES:N1CCC(CC1)NC(=O)OC(C)(C)C	
FORMULA: C10H20N2O2
MASS: 200.2780
EXACT MASS: 200.1524779
INTERATOMIC DISTANCES

              N   1      C   2      C   3      C   4      C   5      C   6
              ------------------------------------------------------------------
   N   1    0.0000 
   C   2    0.7483     0.0000 
   C   3    1.2960     0.7482     0.0000 
   C   4    1.4965     1.2960     0.7482     0.0000 
   C   5    1.2960     1.4965     1.2960     0.7483     0.0000 
   C   6    0.7483     1.2961     1.4966     1.2961     0.7483     0.0000 
   N   7    2.2448     1.9798     1.2961     0.7483     1.2961     1.9798 
   C   8    2.6980     2.5921     1.9798     1.2961     1.4966     2.2449 
   O   9    2.5921     2.6980     2.2448     1.4966     1.2961     1.9798 
   O  10    3.4291     3.2617     2.5922     1.9799     2.2449     2.9932 
   C  11    3.9596     3.8882     3.2617     2.5922     2.6980     3.4291 
   C  12    4.4853     4.3114     3.6248     3.0364     3.2786     4.0247 
   C  13    4.5516     4.5516     3.9596     3.2617     3.2617     3.9596 
   C  14    3.5155     3.5734     3.0429     2.3108     2.2204     2.9051 

              N   7      C   8      O   9      O  10      C  11      C  12
              ------------------------------------------------------------------
   N   7    0.0000 
   C   8    0.7482     0.0000 
   O   9    1.2960     0.7483     0.0000 
   O  10    1.2961     0.7483     1.2961     0.0000 
   C  11    1.9798     1.2961     1.4966     0.7482     0.0000 
   C  12    2.3344     1.7916     2.1771     1.0583     0.7483     0.0000 
   C  13    2.6980     1.9798     1.9798     1.4965     0.7483     1.0582 
   C  14    1.8734     1.1270     0.9274     1.0583     0.7483     1.4966 

              C  13      C  14
              ----------------------
   C  13    0.0000 
   C  14    1.0582     0.0000 



ATOMIC CHARGES
   N   1   -0.2179328005
   C   2    0.0904661067
   C   3    0.0406159607
   C   4    0.1015826681
   C   5    0.0406159607
   C   6    0.0904661067
   N   7   -0.1704022735
   C   8    0.4208501705
   O   9   -0.2245679033
   O  10   -0.4407976458
   C  11    0.1378771122
   C  12    0.0437421792
   C  13    0.0437421792
   C  14    0.0437421792


BOND ANGLES
   6    1    2   C3   N3   C3    120.005
   1    2    3   N3   C3   C3    119.998
   7    4    5  Nam   C3   C3    119.995
   4    5    6   C3   C3   C3    120.005
   2    1    6   C3   N3   C3    120.005
  10    8    9   O3   C2   O2    119.995
   9    8   10   O2   C2   O3    119.995
   8   10   11   C2   O3   C3    120.007
  13   11   12   C3   C3   C3     90.000
  14   11   12   C3   C3   C3    179.974
  12   11   13   C3   C3   C3     90.000
  14   11   13   C3   C3   C3     89.990
  12   11   14   C3   C3   C3    179.974
  13   11   14   C3   C3   C3     89.990
   5    4    7   C3   C3  Nam    119.995
   4    7    8   C3  Nam   C2    120.007


TORSION ANGLES
   6    1    2    3      0.026
   1    2    3    4      0.026
   2    3    4    5      0.026
   2    3    4    7    179.974
   3    4    5    6      0.026
   7    4    5    6    179.974
   4    5    6    1      0.026
   2    1    6    5      0.026
   9    8   10   11      0.026
   7    8   10   11    179.974
   8   10   11   12    179.974
   8   10   11   13      0.026
   8   10   11   14      0.026
   4    7    8    9      0.026
   4    7    8   10    179.974
   3    4    7    8    179.974
   5    4    7    8      0.026


CHIRAL ATOMS
   C     4 is chiral: counterclockwise
   C    11 is chiral: counterclockwise