KEGG   COMPOUND: C06636
Entry
C06636                      Compound                               
Name
TDE;
DDD;
1,1-Dichloro-2,2-bis(4'-chlorophenyl)ethane;
Dichlorodiphenyldichloroethane
Formula
C14H10Cl4
Exact mass
317.9537
Mol weight
320.03
Structure
Reaction
R05384 R05476
Enzyme
4.5.1.-
Brite
Endocrine disrupting compounds [BR:br08006]
 Pesticides and herbicides
  Organochlorine pesticides
   C06636  DDD
Other DBs
CAS: 72-54-8
PubChem: 8862
ChEBI: 27841
NIKKAJI: J2.378G
LinkDB
KCF data

ATOM        18
            1   C1c C    24.9200  -16.4222
            2   C8y C    26.1257  -17.1271
            3   C8y C    23.7086  -17.1271
            4   C1c C    24.9257  -15.0244
            5   C8x C    26.1257  -18.5307
            6   C8x C    27.3430  -16.4281
            7   C8x C    23.7086  -18.5249
            8   C8x C    22.4970  -16.4222
            9   X   Cl   26.1314  -14.3254
            10  X   Cl   23.7086  -14.3254
            11  C8x C    27.3430  -19.2239
            12  C8x C    28.5544  -17.1271
            13  C8x C    22.4970  -19.2239
            14  C8x C    21.2797  -17.1271
            15  C8y C    28.5544  -18.5307
            16  C8y C    21.2797  -18.5249
            17  X   Cl   29.7717  -19.2239
            18  X   Cl   20.0741  -19.2239
BOND        19
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     2   5 2
            5     2   6 1
            6     3   7 1
            7     3   8 2
            8     4   9 1
            9     4  10 1
            10    5  11 1
            11    6  12 2
            12    7  13 2
            13    8  14 1
            14   11  15 2
            15   13  16 1
            16   15  17 1
            17   16  18 1
            18   12  15 1
            19   14  16 2

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