COMPOUND: C08736
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Entry
C08736 Compound
Name
6-Chloro-1,3,5-triazine-2,4(1H,3H)-dione;
2-Chloro-4,6-dihydroxy-1,3,5-triazine
Formula
C3H2ClN3O2
Exact mass
146.9836
Mol weight
147.5199
Structure
Mol file
KCF file
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CAS:
69125-10-6
PubChem:
10929
ChEBI:
1040
NIKKAJI:
J313.838K
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KCF data
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ATOM 9
1 C8y C 26.7878 -20.9327
2 N5x N 28.0000 -21.6295
3 N5x N 26.7878 -19.5273
4 O1a O 25.5756 -21.6295
5 C8y C 29.2122 -20.9327
6 C8y C 28.0000 -18.8305
7 N5x N 29.2122 -19.5273
8 O1a O 30.4244 -21.6295
9 X Cl 28.0058 -17.4307
BOND 9
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 2
5 3 6 1
6 5 7 1
7 5 8 1
8 6 9 1
9 6 7 2
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