COMPOUND: C15249
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Entry
C15249 Compound
Name
2-(3,5-Dichlorophenylcarbamoyl)-1,2-dimethylcyclopropane-1-carboxylic acid
Formula
C13H13Cl2NO3
Exact mass
301.0272
Mol weight
302.1532
Structure
Mol file
KCF file
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CAS:
71937-45-6
PubChem:
17396246
ChEBI:
79751
NIKKAJI:
J31.001H
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KCF data
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ATOM 19
1 C8y C 23.4614 -18.6420
2 C8x C 23.4614 -20.0445
3 C8y C 24.6797 -20.7494
4 C8x C 25.8911 -20.0445
5 C8y C 25.8911 -18.6420
6 C8x C 24.6797 -17.9443
7 N1b N 27.0979 -17.9443
8 C5a C 28.3100 -18.6351
9 C1z C 29.5223 -17.9374
10 O5a O 28.3031 -20.0374
11 X Cl 24.7365 -22.1517
12 X Cl 22.2320 -17.9297
13 C1z C 30.9223 -17.9374
14 C1x C 30.2223 -16.7250
15 C1a C 28.5324 -16.9475
16 C1a C 32.1402 -18.6407
17 C6a C 31.9298 -16.9299
18 O6a O 33.2754 -17.2906
19 O6a O 31.5694 -15.5846
BOND 20
1 1 2 2
2 7 8 1
3 2 3 1
4 8 9 1
5 3 4 2
6 4 5 1
7 8 10 2
8 5 6 2
9 6 1 1
10 3 11 1
11 5 7 1
12 1 12 1
13 9 13 1
14 9 14 1
15 13 14 1
16 9 15 1
17 13 16 1
18 13 17 1
19 17 18 1
20 17 19 2
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