Mrv1652306031607442D          

 27 27  0  0  0  0            999 V2000
    0.1842    1.8695    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2414    0.1433    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8125    0.1433    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0572    1.7262    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5236   -0.9185    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2481   -1.4072    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2448    1.8695    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7111   -0.7752    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2822   -0.7752    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5875    2.3582    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8057   -1.6938    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0340   -2.1825    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1178    2.9902    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    1.9556    2.8885    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    3.2195    1.8279    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    3.0879   -2.4690    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    2.0305   -1.9759    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    3.5810   -1.4116    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8093   -1.9003    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    0.7412   -2.4646    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3162   -2.9577    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    0.8250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.8250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -0.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145    1.2375    0.0000 Si  0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -0.0000    0.0000 Si  0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 Si  0  0  0  0  0  0  0  0  0  0  0  0
  7  4  1  0  0  0  0
  8  5  1  0  0  0  0
  9  6  1  0  0  0  0
 10  4  1  0  0  0  0
 11  5  1  0  0  0  0
 12  6  1  0  0  0  0
 13 10  1  0  0  0  0
 14 10  1  0  0  0  0
 15 10  1  0  0  0  0
 16 11  1  0  0  0  0
 17 11  1  0  0  0  0
 18 11  1  0  0  0  0
 19 12  1  0  0  0  0
 20 12  1  0  0  0  0
 21 12  1  0  0  0  0
 25  1  1  0  0  0  0
 25  7  1  0  0  0  0
 25 22  1  0  0  0  0
 25 23  1  0  0  0  0
 26  2  1  0  0  0  0
 26  8  1  0  0  0  0
 26 22  1  0  0  0  0
 26 24  1  0  0  0  0
 27  3  1  0  0  0  0
 27  9  1  0  0  0  0
 27 23  1  0  0  0  0
 27 24  1  0  0  0  0
M  END
> <DATABASE_ID>
CHEM011083

> <DATABASE_NAME>
chemdb

> <SMILES>
C[Si]1(CCC(F)(F)F)O[Si](C)(CCC(F)(F)F)O[Si](C)(CCC(F)(F)F)O1

> <INCHI_IDENTIFIER>
InChI=1S/C12H21F9O3Si3/c1-25(7-4-10(13,14)15)22-26(2,8-5-11(16,17)18)24-27(3,23-25)9-6-12(19,20)21/h4-9H2,1-3H3

> <INCHI_KEY>
URZHQOCYXDNFGN-UHFFFAOYSA-N

> <FORMULA>
C12H21F9O3Si3

> <MOLECULAR_WEIGHT>
468.538

> <EXACT_MASS>
468.065477608

> <JCHEM_ACCEPTOR_COUNT>
3

> <JCHEM_ATOM_COUNT>
48

> <JCHEM_AVERAGE_POLARIZABILITY>
33.84822983842757

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
2,4,6-trimethyl-2,4,6-tris(3,3,3-trifluoropropyl)-1,3,5,2,4,6-trioxatrisilinane

> <ALOGPS_LOGP>
4.89

> <JCHEM_LOGP>
4.4199

> <ALOGPS_LOGS>
-4.60

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
1

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA_STRONGEST_BASIC>
-3.57334571944573

> <JCHEM_POLAR_SURFACE_AREA>
27.69

> <JCHEM_REFRACTIVITY>
69.18149999999999

> <JCHEM_ROTATABLE_BOND_COUNT>
9

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
1.17e-02 g/l

> <JCHEM_TRADITIONAL_IUPAC>
2,4,6-trimethyl-2,4,6-tris(3,3,3-trifluoropropyl)-1,3,5,2,4,6-trioxatrisilinane

> <JCHEM_VEBER_RULE>
1

> <NAME>
Cyclotrisiloxane, 2,4,6-trimethyl-2,4,6-tris(3,3,3-trifluoropropyl)-

> <CAS>
2374-14-3

> <SYNONYMS>
2,4,6-trimethyl-2,4,6-tris(3,3,3-trifluoropropyl)cyclotrisiloxane

$$$$