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(S)-1-Boc-3-hydroxylpiperidine
(S)-1-Boc-3-hydroxylpiperidine ID: B187222
CAS:143900-44-1
Supplier:BEYOND PHARMATECH CORPORATION LIMITED

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SMILES:C(=O)(N1C[C@@H](O)CCC1)OC(C)(C)C	
FORMULA: C10H19NO3
MASS: 201.2628
EXACT MASS: 201.1364935
INTERATOMIC DISTANCES

              C   1      N   2      O   3      C   4      O   5      C   6
              ------------------------------------------------------------------
   C   1    0.0000 
   N   2    0.7447     0.0000 
   O   3    0.7411     1.2875     0.0000 
   C   4    1.2875     0.7411     1.9645     0.0000 
   O   5    0.7417     1.2864     1.2843     1.4859     0.0000 
   C   6    1.2875     1.9685     0.7447     2.5750     1.4859     0.0000 
   C   7    1.2935     0.7500     1.4900     1.2915     1.9713     2.2347 
   C   8    1.9727     1.2917     2.5792     0.7483     2.2342     3.2462 
   O   9    2.5750     1.9645     3.2380     1.2875     2.6797     3.8625 
   C  10    1.9673     1.2879     2.2291     1.4875     2.5743     2.9738 
   C  11    1.7835     2.3246     1.0572     3.0199     2.1654     0.7468 
   C  12    1.9735     2.6888     1.4951     3.2467     1.9719     0.7504 
   C  13    1.1155     1.8583     1.0481     2.2917     0.9180     0.7432 
   C  14    2.2383     1.4936     2.6860     1.2956     2.6875     3.4142 

              C   7      C   8      O   9      C  10      C  11      C  12
              ------------------------------------------------------------------
   C   7    0.0000 
   C   8    1.4936     0.0000 
   O   9    2.2311     0.7375     0.0000 
   C  10    0.7391     1.2921     1.9673     0.0000 
   C  11    2.3567     3.6105     4.2864     3.0677     0.0000 
   C  12    2.9851     3.9461     4.5281     3.7242     1.0572     0.0000 
   C  13    2.3526     3.0245     3.5460     3.0616     1.4900     1.0591 
   C  14    1.2917     0.7500     1.2894     0.7463     3.6312     4.1537 

              C  13      C  14
              ----------------------
   C  13    0.0000 
   C  14    3.3510     0.0000 



ATOMIC CHARGES
   C   1    0.4047162382
   N   2   -0.2434196226
   O   3   -0.4417874222
   C   4    0.1294571642
   O   5   -0.2261960059
   C   6    0.1378299108
   C   7    0.0969037417
   C   8    0.1718586763
   O   9   -0.2213085855
   C  10    0.0242817670
   C  11    0.0437415187
   C  12    0.0437415187
   C  13    0.0437415187
   C  14    0.0364395820


BOND ANGLES
   2    1    3  Nam   C2   O3    120.116
   2    1    5  Nam   C2   O2    119.863
   3    1    5   O3   C2   O2    120.021
   1    2    4   C2  Nam   C3    120.116
   1    2    7   C2  Nam   C3    119.863
   4    2    7   C3  Nam   C3    120.021
   1    3    6   C2   O3   C3    120.116
   2    4    8  Nam   C3   C3    120.276
   3    6   11   O3   C3   C3     90.279
   3    6   12   O3   C3   C3    179.882
   3    6   13   O3   C3   C3     89.562
  11    6   12   C3   C3   C3     89.839
  11    6   13   C3   C3   C3    179.841
  12    6   13   C3   C3   C3     90.320
   2    7   10  Nam   C3   C3    119.746
   4    8    9   C3   C3   O3    120.113
   4    8   14   C3   C3   C3    119.703
   9    8   14   O3   C3   C3    120.184
   7   10   14   C3   C3   C3    120.824
   8   14   10   C3   C3   C3    119.430


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


CHIRAL ATOMS
   9    8   14   10    179.974