KEGG   COMPOUND: C18653
Entry
C18653                      Compound                               
Name
DNOC;
4,6-Dinitro-o-cresol;
2,4-Dinitro-6-methylphenol
Formula
C7H6N2O5
Exact mass
198.0277
Mol weight
198.13
Structure
Brite
Pesticides [BR:br08007]
 Pesticides
  Herbicides
   Nitrophenol herbicides
    C18653  DNOC
Other DBs
CAS: 534-52-1
PubChem: 124489327
ChEBI: 39349
KCF data

ATOM        14
            1   C8y C    27.2515  -18.1234
            2   C8x C    28.4726  -18.7606
            3   C8y C    29.6350  -18.0218
            4   C8x C    29.5764  -16.6456
            5   C8y C    28.3553  -16.0084
            6   C8y C    27.2629  -16.7473
            7   N2b N    26.0892  -18.8622 #+
            8   O3a O    26.0834  -20.3412
            9   O3a O    24.8682  -18.2251 #-
            10  N2b N    30.8559  -18.6589 #+
            11  O3a O    30.8517  -20.1762
            12  O3a O    32.1243  -17.9941 #-
            13  O1a O    25.9720  -16.1102
            14  C1a C    28.3655  -14.6110
BOND        14
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     1   7 1
            8     7   8 2
            9     7   9 1
            10    3  10 1
            11   10  11 2
            12   10  12 1
            13    6  13 1
            14    5  14 1

» Japanese version

  All links  
Chemical substance (3)   
   PubChem (1)   
   ChEBI (1)   
   HSDB (1)   
All databases (3)   

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