KEGG   COMPOUND: C18933
Entry
C18933                      Compound                               

Name
Chloranil;
p-Chloranil;
2,3,5,6-Tetrachloro-1,4-benzoquinone
Formula
C6Cl4O2
Exact mass
243.8652
Mol weight
245.875
Structure
Reaction
Pathway
map00361  Chlorocyclohexane and chlorobenzene degradation
map01100  Metabolic pathways
map01120  Microbial metabolism in diverse environments
map05208  Chemical carcinogenesis - reactive oxygen species
Enzyme
1.1.1.404       1.14.13.50
Brite
Pesticides [BR:br08007]
 Obsolete pesticides
  Fungicides
   Others
    C18933  Chloranil
Other DBs
CAS: 118-75-2
PubChem: 124489605
ChEBI: 36703
ChEMBL: CHEMBL192627
LinkDB
KCF data

ATOM        12
            1   C2y C    24.4300  -17.7800
            2   C2y C    24.4300  -19.1800
            3   C5x C    25.6424  -19.8800
            4   C2y C    26.8549  -19.1800
            5   C2y C    26.8549  -17.7800
            6   C5x C    25.6424  -17.0800
            7   X   Cl   23.2176  -19.8800
            8   X   Cl   23.2176  -17.0800
            9   X   Cl   28.0860  -17.0690
            10  X   Cl   28.0860  -19.8910
            11  O5x O    25.6424  -15.6802
            12  O5x O    25.6424  -21.2798
BOND        12
            1     1   2 2
            2     2   3 1
            3     3   4 1
            4     4   5 2
            5     5   6 1
            6     1   6 1
            7     2   7 1
            8     1   8 1
            9     5   9 1
            10    4  10 1
            11    6  11 2
            12    3  12 2

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