Mrv0541 02241204102D          

  4  3  0  0  0  0            999 V2000
    1.2375    0.7145    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    0.8250    0.0000    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
    1.2375   -0.7145    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 F   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>
T3D1813

> <DATABASE_NAME>
t3db

> <SMILES>
F[Br](F)F

> <INCHI_IDENTIFIER>
InChI=1S/BrF3/c2-1(3)4

> <INCHI_KEY>
FQFKTKUFHWNTBN-UHFFFAOYSA-N

> <FORMULA>
BrF3

> <MOLECULAR_WEIGHT>
136.899

> <EXACT_MASS>
135.913547262

> <JCHEM_ACCEPTOR_COUNT>
0

> <JCHEM_AVERAGE_POLARIZABILITY>
5.519429467854659

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
trifluoro-λ³-bromane

> <JCHEM_LOGP>
1.4544654620000002

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_POLAR_SURFACE_AREA>
0

> <JCHEM_REFRACTIVITY>
13.239100000000002

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
trifluoro-λ³-bromane

> <JCHEM_VEBER_RULE>
1

> <T3DB_ID>
T3D1813

> <NAME>
Bromine trifluoride

> <CAS>
7787-71-5

> <SYNONYMS>
BrF3; Bromine fluoride; Bromine fluoride (BrF3)

> <TYPES>
Inorganic Compound; Non-Metal; Halogen; Fluoride Compound; Bromide Compound; Industrial/Workplace Toxin; Synthetic Compound

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