KEGG   COMPOUND: C06594Help
Entry
C06594                      Compound                               

Name
1,2,4-Trichlorobenzene;
Trichlorobenzene A
Formula
C6H3Cl3
Exact mass
179.93
Mol weight
181.447
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00361  Chlorocyclohexane and chlorobenzene degradation
map01100  Metabolic pathways
map01120  Microbial metabolism in diverse environments
map01220  Degradation of aromatic compounds
Enzyme
1.14.12.-
Other DBs
CAS: 120-82-1
PubChem: 8820
ChEBI: 28222
ChEMBL: CHEMBL296348
3DMET: B00987
NIKKAJI: J2.482A
KCF data Show

ATOM        9
            1   C8y C    29.4326  -16.2556
            2   C8y C    28.2207  -15.5530
            3   C8x C    29.4326  -17.6546
            4   X   Cl   30.6444  -15.5530
            5   C8x C    27.0089  -16.2556
            6   X   Cl   28.2265  -14.1540
            7   C8y C    28.2207  -18.3571
            8   C8x C    27.0089  -17.6546
            9   X   Cl   28.2265  -19.7564
BOND        9
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 2
            7     5   8 2
            8     7   9 1
            9     7   8 1

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