| Entry |
|
|---|
| Name |
2,2',4,5'-Tetrabromodiphenyl ether;
PBDE 49;
BDE 49
|
|---|
| Formula |
C12H6Br4O
|
|---|
| Exact mass |
481.7152
|
|---|
| Mol weight |
485.7914
|
|---|
| Structure |
|
|---|
| Brite |
Endocrine disrupting compounds [BR:br08006]
Flame retardants
PBDEs
C18204 2,2',4,5'-Tetrabromodiphenyl ether (PBDE 49)
|
|---|
| Other DBs |
|
|---|
| LinkDB |
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|---|
| KCF data |
ATOM 17
1 C8x C 17.9200 -17.8500
2 C8x C 17.9200 -19.2500
3 C8y C 19.1324 -19.9500
4 C8x C 20.3449 -19.2500
5 C8y C 20.3449 -17.8500
6 C8y C 19.1324 -17.1500
7 O2a O 21.5760 -17.1390
8 C8y C 22.7812 -17.8347
9 C8x C 22.7816 -19.2496
10 C8x C 23.9942 -19.9493
11 C8y C 25.2065 -19.2489
12 C8x C 25.2060 -17.8339
13 C8y C 23.9934 -17.1343
14 X Br 19.1324 -21.3498
15 X Br 19.1324 -15.7502
16 X Br 23.9932 -15.7501
17 X Br 26.4147 -19.9460
BOND 18
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 5 7 1
8 7 8 1
9 8 9 2
10 9 10 1
11 10 11 2
12 11 12 1
13 12 13 2
14 8 13 1
15 3 14 1
16 6 15 1
17 13 16 1
18 11 17 1
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|---|
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