Mrv1572004191603232D          

 16 17  0  0  0  0            999 V2000
    5.4776   -2.8875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0006   -0.9355    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5256   -2.3645    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3342    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6197    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0487   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0487   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6197   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3342    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9053    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9053    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4776   -2.0625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1756   -0.9355    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3506   -2.3645    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1908    0.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7631   -1.6500    0.0000 Si  0  0  0  0  0  0  0  0  0  0  0  0
  5  4  1  0  0  0  0
  7  6  1  0  0  0  0
  9  4  1  0  0  0  0
  9  6  1  0  0  0  0
  9  8  1  0  0  0  0
 10  5  1  0  0  0  0
 11  8  1  0  0  0  0
 11 10  1  0  0  0  0
 12  1  1  0  0  0  0
 13  2  1  0  0  0  0
 14  3  1  0  0  0  0
 15 10  1  0  0  0  0
 15 11  1  0  0  0  0
 16  7  1  0  0  0  0
 16 12  1  0  0  0  0
 16 13  1  0  0  0  0
 16 14  1  0  0  0  0
M  END
> <DATABASE_ID>
CHEM011890

> <DATABASE_NAME>
chemdb

> <SMILES>
CO[Si](CCC1CCC2OC2C1)(OC)OC

> <INCHI_IDENTIFIER>
InChI=1S/C11H22O4Si/c1-12-16(13-2,14-3)7-6-9-4-5-10-11(8-9)15-10/h9-11H,4-8H2,1-3H3

> <INCHI_KEY>
DQZNLOXENNXVAD-UHFFFAOYSA-N

> <FORMULA>
C11H22O4Si

> <MOLECULAR_WEIGHT>
246.378

> <EXACT_MASS>
246.128735723

> <JCHEM_ACCEPTOR_COUNT>
4

> <JCHEM_ATOM_COUNT>
38

> <JCHEM_AVERAGE_POLARIZABILITY>
26.382710270626916

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
trimethoxy(2-{7-oxabicyclo[4.1.0]heptan-3-yl}ethyl)silane

> <ALOGPS_LOGP>
2.54

> <JCHEM_LOGP>
1.541

> <ALOGPS_LOGS>
-2.46

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
2

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA_STRONGEST_BASIC>
-3.6258556097069827

> <JCHEM_POLAR_SURFACE_AREA>
40.22

> <JCHEM_REFRACTIVITY>
56.5337

> <JCHEM_ROTATABLE_BOND_COUNT>
6

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
8.47e-01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
trimethoxy(2-{7-oxabicyclo[4.1.0]heptan-3-yl}ethyl)silane

> <JCHEM_VEBER_RULE>
0

> <NAME>
7-Oxabicyclo[4.1.0]heptane, 3-[2-(trimethoxysilyl)ethyl]-

> <CAS>
3388-04-3

> <SYNONYMS>
beta-(3,4-Epoxycyclohexyl)ethyltrimethoxysilane; trimethoxy(2-{7-oxabicyclo[4.1.0]heptan-3-yl}ethyl)silane

$$$$