COMPOUND: C14859
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Entry
C14859 Compound
Name
Chloroacetyl chloride
Formula
C2H2Cl2O
Exact mass
111.9483
Mol weight
112.94
Structure
Mol file
KCF file
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Reaction
R07090
R07093
R07096
Pathway
map00980
Metabolism of xenobiotics by cytochrome P450
Enzyme
1.14.14.-
2.5.1.18
Other DBs
CAS:
79-04-9
PubChem:
17395857
ChEBI:
34624
NIKKAJI:
J1.490G
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KCF data
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ATOM 5
1 X Cl 17.3600 -19.7400
2 C1b C 18.5500 -20.4400
3 C5a C 19.8100 -19.7400
4 X Cl 21.0000 -20.4400
5 O5a O 19.8100 -18.3400
BOND 4
1 1 2 1
2 2 3 1
3 3 4 1
4 3 5 2
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