Mrv1652306031607532D          

 29 28  0  0  0  0            999 V2000
   -2.4750    0.6039    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4750    2.2539    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4750   -2.2539    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4750   -0.6039    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9520    0.3020    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5230    1.1270    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5230   -1.1270    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9520   -0.3020    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0000    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5375    2.1434    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5375   -2.1434    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9500    2.8579    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9500   -2.8579    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7125    2.1434    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7125   -2.1434    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7750    2.8579    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7750   -2.8579    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3000    1.4289    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3000   -1.4289    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6500    1.4289    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6500   -1.4289    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8250   -0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8250    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4750    1.4289    0.0000 Si  0  0  0  0  0  0  0  0  0  0  0  0
    2.4750   -1.4289    0.0000 Si  0  0  0  0  0  0  0  0  0  0  0  0
   -1.2375    0.7145    0.0000 Si  0  0  0  0  0  0  0  0  0  0  0  0
    1.2375   -0.7145    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
 13 11  1  0  0  0  0
 14 12  1  0  0  0  0
 15 11  1  0  0  0  0
 16 12  1  0  0  0  0
 17 13  1  0  0  0  0
 18 14  1  0  0  0  0
 19 15  1  0  0  0  0
 20 16  1  0  0  0  0
 25  1  1  0  0  0  0
 25  2  1  0  0  0  0
 25 19  1  0  0  0  0
 25 21  1  0  0  0  0
 26  3  1  0  0  0  0
 26  4  1  0  0  0  0
 26 20  1  0  0  0  0
 26 22  1  0  0  0  0
 27  5  1  0  0  0  0
 27  6  1  0  0  0  0
 27 21  1  0  0  0  0
 27 23  1  0  0  0  0
 28  7  1  0  0  0  0
 28  8  1  0  0  0  0
 28 22  1  0  0  0  0
 28 24  1  0  0  0  0
 29  9  1  0  0  0  0
 29 10  1  0  0  0  0
 29 23  1  0  0  0  0
 29 24  1  0  0  0  0
M  END
> <DATABASE_ID>
CHEM044221

> <DATABASE_NAME>
chemdb

> <SMILES>
C[Si](C)(OCCCO)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)OCCCO

> <INCHI_IDENTIFIER>
InChI=1S/C16H44O8Si5/c1-25(2,19-15-11-13-17)21-27(5,6)23-29(9,10)24-28(7,8)22-26(3,4)20-16-12-14-18/h17-18H,11-16H2,1-10H3

> <INCHI_KEY>
TZSHYDMZCJSAKC-UHFFFAOYSA-N

> <FORMULA>
C16H44O8Si5

> <MOLECULAR_WEIGHT>
504.945

> <EXACT_MASS>
504.188251052

> <JCHEM_ACCEPTOR_COUNT>
8

> <JCHEM_ATOM_COUNT>
73

> <JCHEM_AVERAGE_POLARIZABILITY>
51.162645038029

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
2

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
5,5,7,7,9,9,11,11,13,13-decamethyl-4,6,8,10,12,14-hexaoxa-5,7,9,11,13-pentasilaheptadecane-1,17-diol

> <ALOGPS_LOGP>
3.92

> <JCHEM_LOGP>
-0.3117999999999975

> <ALOGPS_LOGS>
-4.95

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
16.202409125412064

> <JCHEM_PKA_STRONGEST_ACIDIC>
15.600349134084102

> <JCHEM_PKA_STRONGEST_BASIC>
-2.404536768648187

> <JCHEM_POLAR_SURFACE_AREA>
95.84000000000002

> <JCHEM_REFRACTIVITY>
101.267

> <JCHEM_ROTATABLE_BOND_COUNT>
16

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
5.67e-03 g/l

> <JCHEM_TRADITIONAL_IUPAC>
5,5,7,7,9,9,11,11,13,13-decamethyl-4,6,8,10,12,14-hexaoxa-5,7,9,11,13-pentasilaheptadecane-1,17-diol

> <JCHEM_VEBER_RULE>
0

> <NAME>
5,5,7,7,9,9,11,11,13,13-decamethyl-4,6,8,10,12,14-hexaoxa-5,7,9,11,13-pentasilaheptadecane-1,17-diol

> <CAS>
104780-66-7

$$$$