KEGG   COMPOUND: C19182Help
Entry
C19182                      Compound                               

Name
Tris(2,3-dibromopropyl) phosphate
Formula
C9H15Br6O4P
Exact mass
691.5808
Mol weight
697.6108
Structure
Mol fileKCF fileDB search
Brite
Carcinogens [BR:br08008]
 Group 2A: Probably carcinogenic to humans
  Compounds
   C19182  Tris(2,3-dibromopropyl) phosphate
BRITE hierarchy
Other DBs
CAS: 126-72-7
PubChem: 124489854
ChEBI: 82282
ChEMBL: CHEMBL1904600
LinkDB All DBs
KCF data Show

ATOM        20
            1   P1b P    20.0200  -17.7800
            2   O3b O    20.0200  -16.3800
            3   O2b O    18.8076  -18.4800
            4   O2b O    21.2324  -18.4800
            5   C1b C    22.4279  -17.7896
            6   C1c C    23.6153  -18.4751
            7   O2b O    20.0200  -19.1800
            8   C1b C    18.8076  -19.8800
            9   C1c C    18.8076  -21.2800
            10  C1b C    24.8065  -17.7871
            11  C1b C    17.6121  -17.7896
            12  C1c C    16.4247  -18.4751
            13  C1b C    15.2335  -17.7871
            14  X   Br   23.6155  -19.8798
            15  X   Br   25.9960  -18.4738
            16  X   Br   16.4246  -19.8798
            17  X   Br   14.0440  -18.4738
            18  X   Br   17.6121  -21.9704
            19  C1b C    20.0368  -21.9897
            20  X   Br   21.2407  -21.2946
BOND        19
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     4   5 1
            5     5   6 1
            6     1   7 1
            7     7   8 1
            8     8   9 1
            9     6  10 1
            10    3  11 1
            11   11  12 1
            12   12  13 1
            13    6  14 1
            14   10  15 1
            15   12  16 1
            16   13  17 1
            17    9  18 1
            18    9  19 1
            19   19  20 1

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