COMPOUND: C21104
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Entry
C21104 Compound
Name
2,5-Dichloro-p-benzoquinone;
2,5-Dichloro-1,4-benzoquinone
Formula
C6H2Cl2O2
Exact mass
175.9432
Mol weight
176.98
Structure
Mol file
KCF file
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Reaction
R05447
R11092
Pathway
map00361
Chlorocyclohexane and chlorobenzene degradation
map01100
Metabolic pathways
map01120
Microbial metabolism in diverse environments
Enzyme
1.14.14.-
Other DBs
CAS:
615-93-0
PubChem:
312642073
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KCF data
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ATOM 10
1 C5x C 18.6198 -14.7731
2 C2y C 19.8303 -15.4658
3 C2x C 17.4034 -15.4658
4 O5x O 18.6255 -13.3705
5 C2x C 19.8303 -16.8683
6 X Cl 21.0409 -14.7731
7 C2y C 17.4034 -16.8683
8 C5x C 18.6198 -17.5725
9 X Cl 16.1929 -17.5725
10 O5x O 18.6255 -18.9693
BOND 10
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 2
5 2 6 1
6 3 7 2
7 5 8 1
8 7 9 1
9 8 10 2
10 7 8 1
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