Mrv1652306031609012D          

 11 10  0  0  0  0            999 V2000
    0.8250   -0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8250   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8250    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6500   -0.8250    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
    0.8250   -2.4750    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -0.8250    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    1.6500   -1.6500    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -1.6500    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    0.8250    0.8250    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    1.6500   -0.0000    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
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  1  1  0  0  0  0
  5  2  1  0  0  0  0
  6  1  1  0  0  0  0
  7  2  1  0  0  0  0
  8  2  1  0  0  0  0
  9  3  1  0  0  0  0
 10  3  1  0  0  0  0
 11  3  1  0  0  0  0
M  END
> <DATABASE_ID>
CHEM013569

> <DATABASE_NAME>
chemdb

> <SMILES>
FC(F)(F)C(F)(Br)C(F)(F)Br

> <INCHI_IDENTIFIER>
InChI=1S/C3Br2F6/c4-1(6,2(5,7)8)3(9,10)11

> <INCHI_KEY>
KTULQNFKNLFOHL-UHFFFAOYSA-N

> <FORMULA>
C3Br2F6

> <MOLECULAR_WEIGHT>
309.831

> <EXACT_MASS>
307.827095

> <JCHEM_ACCEPTOR_COUNT>
0

> <JCHEM_ATOM_COUNT>
11

> <JCHEM_AVERAGE_POLARIZABILITY>
12.944247477461392

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
1,2-dibromo-1,1,2,3,3,3-hexafluoropropane

> <ALOGPS_LOGP>
2.98

> <JCHEM_LOGP>
3.3804557546666665

> <ALOGPS_LOGS>
-2.97

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_POLAR_SURFACE_AREA>
0.0

> <JCHEM_REFRACTIVITY>
32.91559999999999

> <JCHEM_ROTATABLE_BOND_COUNT>
2

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
3.35e-01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
1,2-dibromo-1,1,2,3,3,3-hexafluoropropane

> <JCHEM_VEBER_RULE>
1

> <NAME>
Propane, 1,2-dibromo-1,1,2,3,3,3-hexafluoro-

> <CAS>
661-95-0

> <SYNONYMS>
1,2-dibromo-1,1,2,3,3,3-hexafluoropropane

$$$$