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2-Amino-4-methylphenol
2-Amino-4-methylphenol ID: CHB83153
CAS:95-84-1
Supplier:ChemiK Co.,Ltd.

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SMILES:c1(c(cc(cc1)C)N)O	
FORMULA: C7H9NO
MASS: 123.1525
EXACT MASS: 123.0684139
INTERATOMIC DISTANCES

              C   1      C   2      C   3      C   4      C   5      C   6
              ------------------------------------------------------------------
   C   1    0.0000 
   C   2    0.8462     0.0000 
   C   3    1.4657     0.8463     0.0000 
   C   4    1.6925     1.4658     0.8463     0.0000 
   C   5    1.4658     1.6925     1.4657     0.8462     0.0000 
   C   6    0.8463     1.4658     1.6925     1.4658     0.8463     0.0000 
   C   7    2.5388     2.2390     1.4658     0.8463     1.4657     2.2390 
   N   8    1.4656     0.8462     1.4657     2.2389     2.5387     2.2389 
   O   9    0.8462     1.4657     2.2389     2.5387     2.2390     1.4657 

              C   7      N   8      O   9
              ---------------------------------
   C   7    0.0000 
   N   8    2.9315     0.0000 
   O   9    3.3850     1.6925     0.0000 



ATOMIC CHARGES
   C   1    0.2122418808
   C   2    0.1275270412
   C   3    0.0170657255
   C   4   -0.0203046369
   C   5   -0.0008864446
   C   6    0.0431256563
   C   7    0.0310733696
   N   8   -0.1247170103
   O   9   -0.2851255816


BOND ANGLES
   2    1    6  Car  Car  Car    120.004
   2    1    9  Car  Car   O3    120.007
   6    1    9  Car  Car   O3    119.990
   1    2    3  Car  Car  Car    119.998
   1    2    8  Car  Car  Npl    120.001
   3    2    8  Car  Car  Npl    120.001
   2    3    4  Car  Car  Car    120.005
   3    4    5  Car  Car  Car    119.998
   3    4    7  Car  Car   C3    120.005
   5    4    7  Car  Car   C3    119.998
   4    5    6  Car  Car  Car    120.004
   1    6    5  Car  Car  Car    119.993


TORSION ANGLES
   6    1    2    3      0.026
   6    1    2    8    179.974
   9    1    2    3    179.974
   9    1    2    8      0.026
   1    2    3    4      0.026
   8    2    3    4    179.974
   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    1    6    5    179.974