COMPOUND: C11000
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Entry
C11000 Compound
Name
Dichloran;
Dicloran;
2,6-Dichloro-4-nitroaniline;
DCNA
Formula
C6H4Cl2N2O2
Exact mass
205.9650
Mol weight
207.01
Structure
Mol file
KCF file
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Brite
Pesticides [BR:
br08007
]
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C11000 Dichloran
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CAS:
99-30-9
PubChem:
13183
ChEBI:
27864
NIKKAJI:
J5.236A
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KCF data
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ATOM 12
1 C8y C 27.1631 -16.9276
2 C8x C 27.1631 -18.3278
3 C8y C 28.3796 -19.0313
4 C8x C 29.5890 -18.3278
5 C8y C 29.5890 -16.9276
6 C8y C 28.3796 -16.2310
7 X Cl 25.9499 -16.2303
8 X Cl 30.8030 -16.2318
9 N1a N 28.3813 -14.8307
10 N2b N 28.3813 -20.4316 #+
11 O3a O 27.1687 -21.1297
12 O3a O 29.5958 -21.1266 #-
BOND 12
1 6 1 1
2 1 7 1
3 1 2 2
4 5 8 1
5 2 3 1
6 6 9 1
7 3 4 2
8 3 10 1
9 4 5 1
10 10 11 2
11 5 6 2
12 10 12 1
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