COMPOUND: C10999
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Entry
C10999 Compound
Name
4,4'-Methylene-bis-(2-chloroaniline);
Methylenebis(chloroaniline);
MOCA
Formula
C13H12Cl2N2
Exact mass
266.0378
Mol weight
267.1538
Structure
Mol file
KCF file
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CAS:
101-14-4
PubChem:
13182
ChEBI:
28124
NIKKAJI:
J3.595E
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KCF data
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ATOM 17
1 C8y C 29.5873 -17.2593
2 C8x C 29.5804 -18.6610
3 C8x C 30.7917 -19.3716
4 C8y C 32.0101 -18.6732
5 C8y C 32.0172 -17.2715
6 C8x C 30.8059 -16.5680
7 C8y C 24.7410 -17.2663
8 C8y C 24.7410 -18.6681
9 C8x C 25.9588 -19.3726
10 C8x C 27.1696 -18.6681
11 C8y C 27.1696 -17.2663
12 C8x C 25.9588 -16.5689
13 C1b C 28.3758 -16.5689
14 X Cl 23.5334 -16.5684
15 X Cl 33.2287 -16.5802
16 N1a N 33.2145 -19.3838
17 N1a N 23.5334 -19.3731
BOND 18
1 4 5 1
2 5 6 2
3 7 8 2
4 8 9 1
5 9 10 2
6 10 11 1
7 11 12 2
8 12 7 1
9 6 1 1
10 11 13 1
11 13 1 1
12 7 14 1
13 1 2 2
14 5 15 1
15 2 3 1
16 4 16 1
17 3 4 2
18 8 17 1
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