KEGG   COMPOUND: C18767Help
Entry
C18767                      Compound                               

Name
2,3,6-TBA;
2,3,6-Trichlorobenzoic acid
Formula
C7H3Cl3O2
Exact mass
223.9199
Mol weight
225.4565
Structure
Mol fileKCF fileDB search
Brite
Pesticides [BR:br08007]
 Pesticides
  Herbicides
   Benzoic acid herbicides
    C18767  2,3,6-TBA
BRITE hierarchy
Other DBs
CAS: 50-31-7
PubChem: 124489441
ChEBI: 81946
ChEMBL: CHEMBL2260696
KCF data Show

ATOM        12
            1   C8x C    13.2300  -15.7500
            2   C8x C    13.2300  -17.1500
            3   C8y C    14.4424  -17.8500
            4   C8y C    15.6549  -17.1500
            5   C8y C    15.6549  -15.7500
            6   C8y C    14.4424  -15.0500
            7   C6a C    16.8860  -15.0390
            8   X   Cl   14.4424  -13.6502
            9   X   Cl   16.8860  -17.8610
            10  X   Cl   14.4424  -19.2498
            11  O6a O    18.0912  -15.7347
            12  O6a O    16.8857  -13.6501
BOND        12
            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     5   7 1
            8     6   8 1
            9     4   9 1
            10    3  10 1
            11    7  11 1
            12    7  12 2

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