KEGG   COMPOUND: C14574Help
Entry
C14574                      Compound                               

Name
Chlorobenzilate;
Ethyl-4,4'-dichlorobenzilate;
Ethyl 2-hydroxy-2,2-bis(4-chlorophenyl)acetate
Formula
C16H14Cl2O3
Exact mass
324.032
Mol weight
325.1866
Structure
Mol fileKCF fileDB search
Brite
Pesticides [BR:br08007]
 Obsolete pesticides
  Insecticides
   Acaricides
    C14574  Chlorobenzilate
Carcinogens [BR:br08008]
 Group 3: Not classifiable as to its carcinogenicity to humans
  Compounds
   C14574  Chlorobenzilate
BRITE hierarchy
Other DBs
CAS: 510-15-6
PubChem: 17395574
ChEBI: 34626
ChEMBL: CHEMBL539904
NIKKAJI: J3.285I
LinkDB All DBs
KCF data Show

ATOM        21
            1   C8x C    24.7123  -18.2731
            2   C8y C    24.7123  -19.6735
            3   C8x C    25.9727  -20.3737
            4   C8x C    27.1630  -19.6735
            5   C8y C    27.1630  -18.2731
            6   C8x C    25.9727  -17.5729
            7   X   Cl   23.5219  -20.3737
            8   C1d C    28.3534  -17.5729
            9   C8y C    29.5438  -18.3431
            10  C8x C    29.5438  -19.6735
            11  C8x C    30.8042  -20.4437
            12  C8y C    31.9945  -19.7435
            13  C8x C    31.9945  -18.3431
            14  C8x C    30.8042  -17.6429
            15  X   Cl   33.1849  -20.4437
            16  C7a C    29.0534  -16.3604
            17  O1a O    27.3563  -16.5838
            18  O7a O    30.4499  -16.3605
            19  C1b C    31.1416  -15.1627
            20  O6a O    28.3610  -15.1613
            21  C1a C    32.5416  -15.1627
BOND        22
            1     2   3 1
            2     8   9 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     6   1 1
            7     2   7 1
            8     1   2 2
            9     9  10 2
            10   10  11 1
            11   11  12 2
            12   12  13 1
            13   13  14 2
            14   14   9 1
            15    5   8 1
            16   12  15 1
            17    8  16 1
            18    8  17 1
            19   16  18 1
            20   18  19 1
            21   16  20 2
            22   19  21 1

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