Mrv0541 02241204122D          

  4  3  0  0  0  0            999 V2000
    1.2375    0.7145    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
    0.8250    0.0000    0.0000 Se  0  0  0  0  0  0  0  0  0  0  0  0
    1.2375   -0.7145    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  2  0  0  0  0
M  END
> <DATABASE_ID>
T3D1751

> <DATABASE_NAME>
t3db

> <SMILES>
Br[Se](Br)=O

> <INCHI_IDENTIFIER>
InChI=1S/Br2OSe/c1-4(2)3

> <INCHI_KEY>
ZWTYAOCEBBZVQQ-UHFFFAOYSA-N

> <FORMULA>
Br2OSe

> <MOLECULAR_WEIGHT>
254.77

> <EXACT_MASS>
253.748111744

> <JCHEM_ACCEPTOR_COUNT>
1

> <JCHEM_AVERAGE_POLARIZABILITY>
10.813799500144437

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
selenooyl dibromide

> <JCHEM_LOGP>
1.6661000000000001

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA_STRONGEST_BASIC>
-9.793836573475309

> <JCHEM_POLAR_SURFACE_AREA>
17.07

> <JCHEM_REFRACTIVITY>
32.028200000000005

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
selenium oxybromide

> <JCHEM_VEBER_RULE>
1

> <T3DB_ID>
T3D1751

> <NAME>
Selenium oxybromide

> <CAS>
7789-51-7

> <SYNONYMS>
Seleninyl bromide

> <TYPES>
Inorganic Compound; Non-Metal; Selenium Compound; Bromide Compound; Pollutant; Industrial/Workplace Toxin; Synthetic Compound

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