Mrv0541 02241205242D          

  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 B   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 Br  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  1  0  0  0  0
M  END
> <DATABASE_ID>
T3D1723

> <DATABASE_NAME>
t3db

> <SMILES>
BrB(Br)Br

> <INCHI_IDENTIFIER>
InChI=1S/BBr3/c2-1(3)4

> <INCHI_KEY>
ILAHWRKJUDSMFH-UHFFFAOYSA-N

> <FORMULA>
BBr3

> <MOLECULAR_WEIGHT>
250.523

> <EXACT_MASS>
247.764318407

> <JCHEM_ACCEPTOR_COUNT>
0

> <JCHEM_AVERAGE_POLARIZABILITY>
11.973221228225658

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
tribromoborane

> <JCHEM_LOGP>
2.3303000000000003

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_POLAR_SURFACE_AREA>
0

> <JCHEM_REFRACTIVITY>
26.205600000000004

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
boron tribromide

> <JCHEM_VEBER_RULE>
1

> <T3DB_ID>
T3D1723

> <NAME>
Boron tribromide

> <CAS>
10294-33-4

> <SYNONYMS>
Boron bromide; Boron bromide (BBr3); Boron tribromide solution; Tribromoborane; Tribromoboron; Trona

> <TYPES>
Inorganic Compound; Bromide Compound; Industrial/Workplace Toxin; Synthetic Compound

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