[6-[(3-ethyloxetan-3-yl)methoxymethyl]-7-oxabicyclo[2.2.1]heptan-2-yl]silane;8-silyl-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;9-silyl-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;8-silyl-4-oxatricyclo[5.2.1.02,6]decan-3-one;9-silyl-4-oxatricyclo[5.2.1.02,6]decan-3-one;9-(3-silylpropoxy)-4-oxatricyclo[5.2.1.02,6]decan-3-one;6-(3-silylpropoxy)spiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[bicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-silylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-silylspiro[bicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;5-silylspiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-silylspiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-silylspiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one

C148H238O39Si15 — CID 159189123

IUPAC[6-[(3-ethyloxetan-3-yl)methoxymethyl]-7-oxabicyclo[2.2.1]heptan-2-yl]silane;8-silyl-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;9-silyl-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;8-silyl-4-oxatricyclo[5.2.1.02,6]decan-3-one;9-silyl-4-oxatricyclo[5.2.1.02,6]decan-3-one;9-(3-silylpropoxy)-4-oxatricyclo[5.2.1.02,6]decan-3-one;6-(3-silylpropoxy)spiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[bicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-silylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-silylspiro[bicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;5-silylspiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-silylspiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-silylspiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one
SMILESCCC1(COCC2CC3CC([SiH3])C2O3)COC1.O=C1CC2(CO1)CC1CC([SiH3])C2C1.O=C1CC2(CO1)CC1CC([SiH3])C2O1.O=C1CC2(CO1)CC1CC2CC1[SiH3].O=C1CC2(CO1)CC1OC2CC1[SiH3].O=C1OCC2C3CC(CC3[SiH3])C12.O=C1OCC2C3CC(OCCC[SiH3])C(C3)C12.O=C1OCC2C3CC([SiH3])C(C3)C12.O=C1OCC2C3CC([SiH3])C(O3)C12.O=C1OCC2C3OC(CC3[SiH3])C12.O=C1OCCC12CC1CC(OCCC[SiH3])C2C1.O=C1OCCC12CC1CC([SiH3])C2C1.O=C1OCCC12CC1CC([SiH3])C2O1.O=C1OCCC12CC1CC2CC1[SiH3].O=C1OCCC12CC1OC2CC1[SiH3]
InChIInChI=1S/C13H22O3Si.C13H24O3Si.C12H20O3Si.4C10H16O2Si.4C9H14O3Si.2C9H14O2Si.2C8H12O3Si/c14-12-13(2-4-16-12)8-9-6-10(13)11(7-9)15-3-1-5-17;1-2-13(7-15-8-13)6-14-5-9-3-10-4-11(17)12(9)16-10;13-12-11-8-4-7(9(11)6-15-12)5-10(8)14-2-1-3-16;11-9-4-10(5-12-9)3-6-1-7(10)2-8(6)13;11-9-4-10(5-12-9)3-6-1-7(10)8(13)2-6;11-9-10(1-2-12-9)5-6-3-7(10)4-8(6)13;11-9-10(1-2-12-9)5-6-3-7(10)8(13)4-6;10-8-3-9(4-11-8)2-5-6(13)1-7(9)12-5;10-7-3-9(4-11-7)2-5-1-6(13)8(9)12-5;10-8-9(1-2-11-8)4-5-6(13)3-7(9)12-5;10-8-9(1-2-11-8)4-5-3-6(13)7(9)12-5;10-9-8-4-1-5(7(12)2-4)6(8)3-11-9;10-9-8-5-1-4(2-7(5)12)6(8)3-11-9;9-8-6-3(2-10-8)7-5(12)1-4(6)11-7;9-8-6-3(2-10-8)4-1-5(12)7(6)11-4/h9-11H,1-8H2,17H3;9-12H,2-8H2,1,17H3;7-11H,1-6H2,16H3;4*6-8H,1-5H2,13H3;5-7H,1-4H2,13H3;5-6,8H,1-4H2,13H3;2*5-7H,1-4H2,13H3;2*4-8H,1-3H2,12H3;2*3-7H,1-2H2,12H3
InChIKeyKNWAXAGPUKPISA-UHFFFAOYSA-N
MW3062.78 g/mol
LogP0.74
Rot. Bonds13

About [6-[(3-ethyloxetan-3-yl)methoxymethyl]-7-oxabicyclo[2.2.1]heptan-2-yl]silane;8-silyl-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;9-silyl-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;8-silyl-4-oxatricyclo[5.2.1.02,6]decan-3-one;9-silyl-4-oxatricyclo[5.2.1.02,6]decan-3-one;9-(3-silylpropoxy)-4-oxatricyclo[5.2.1.02,6]decan-3-one;6-(3-silylpropoxy)spiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[bicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-silylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-silylspiro[bicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;5-silylspiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-silylspiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-silylspiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one

[6-[(3-ethyloxetan-3-yl)methoxymethyl]-7-oxabicyclo[2.2.1]heptan-2-yl]silane;8-silyl-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;9-silyl-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;8-silyl-4-oxatricyclo[5.2.1.02,6]decan-3-one;9-silyl-4-oxatricyclo[5.2.1.02,6]decan-3-one;9-(3-silylpropoxy)-4-oxatricyclo[5.2.1.02,6]decan-3-one;6-(3-silylpropoxy)spiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[bicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-silylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-silylspiro[bicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;5-silylspiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-silylspiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-silylspiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one (PubChem CID 159189123) has the molecular formula C148H238O39Si15 and a molecular weight of 3062.78 g/mol. Its IUPAC name is [6-[(3-ethyloxetan-3-yl)methoxymethyl]-7-oxabicyclo[2.2.1]heptan-2-yl]silane;8-silyl-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;9-silyl-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;8-silyl-4-oxatricyclo[5.2.1.02,6]decan-3-one;9-silyl-4-oxatricyclo[5.2.1.02,6]decan-3-one;9-(3-silylpropoxy)-4-oxatricyclo[5.2.1.02,6]decan-3-one;6-(3-silylpropoxy)spiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[bicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-silylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-silylspiro[bicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;5-silylspiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-silylspiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-silylspiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one.

Molecular Properties

Compound Name[6-[(3-ethyloxetan-3-yl)methoxymethyl]-7-oxabicyclo[2.2.1]heptan-2-yl]silane;8-silyl-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;9-silyl-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;8-silyl-4-oxatricyclo[5.2.1.02,6]decan-3-one;9-silyl-4-oxatricyclo[5.2.1.02,6]decan-3-one;9-(3-silylpropoxy)-4-oxatricyclo[5.2.1.02,6]decan-3-one;6-(3-silylpropoxy)spiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[bicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-silylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-silylspiro[bicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;5-silylspiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-silylspiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-silylspiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one
PubChem CID159189123
Molecular FormulaC148H238O39Si15
Molecular Weight3062.78 g/mol
Exact Mass3059.32
IUPAC Name[6-[(3-ethyloxetan-3-yl)methoxymethyl]-7-oxabicyclo[2.2.1]heptan-2-yl]silane;8-silyl-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;9-silyl-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;8-silyl-4-oxatricyclo[5.2.1.02,6]decan-3-one;9-silyl-4-oxatricyclo[5.2.1.02,6]decan-3-one;9-(3-silylpropoxy)-4-oxatricyclo[5.2.1.02,6]decan-3-one;6-(3-silylpropoxy)spiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[bicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-silylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-silylspiro[bicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;5-silylspiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-silylspiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-silylspiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one
SMILESCCC1(COCC2CC3CC([SiH3])C2O3)COC1.O=C1CC2(CO1)CC1CC([SiH3])C2C1.O=C1CC2(CO1)CC1CC([SiH3])C2O1.O=C1CC2(CO1)CC1CC2CC1[SiH3].O=C1CC2(CO1)CC1OC2CC1[SiH3].O=C1OCC2C3CC(CC3[SiH3])C12.O=C1OCC2C3CC(OCCC[SiH3])C(C3)C12.O=C1OCC2C3CC([SiH3])C(C3)C12.O=C1OCC2C3CC([SiH3])C(O3)C12.O=C1OCC2C3OC(CC3[SiH3])C12.O=C1OCCC12CC1CC(OCCC[SiH3])C2C1.O=C1OCCC12CC1CC([SiH3])C2C1.O=C1OCCC12CC1CC([SiH3])C2O1.O=C1OCCC12CC1CC2CC1[SiH3].O=C1OCCC12CC1OC2CC1[SiH3]
InChIInChI=1S/C13H22O3Si.C13H24O3Si.C12H20O3Si.4C10H16O2Si.4C9H14O3Si.2C9H14O2Si.2C8H12O3Si/c14-12-13(2-4-16-12)8-9-6-10(13)11(7-9)15-3-1-5-17;1-2-13(7-15-8-13)6-14-5-9-3-10-4-11(17)12(9)16-10;13-12-11-8-4-7(9(11)6-15-12)5-10(8)14-2-1-3-16;11-9-4-10(5-12-9)3-6-1-7(10)2-8(6)13;11-9-4-10(5-12-9)3-6-1-7(10)8(13)2-6;11-9-10(1-2-12-9)5-6-3-7(10)4-8(6)13;11-9-10(1-2-12-9)5-6-3-7(10)8(13)4-6;10-8-3-9(4-11-8)2-5-6(13)1-7(9)12-5;10-7-3-9(4-11-7)2-5-1-6(13)8(9)12-5;10-8-9(1-2-11-8)4-5-6(13)3-7(9)12-5;10-8-9(1-2-11-8)4-5-3-6(13)7(9)12-5;10-9-8-4-1-5(7(12)2-4)6(8)3-11-9;10-9-8-5-1-4(2-7(5)12)6(8)3-11-9;9-8-6-3(2-10-8)7-5(12)1-4(6)11-7;9-8-6-3(2-10-8)4-1-5(12)7(6)11-4/h9-11H,1-8H2,17H3;9-12H,2-8H2,1,17H3;7-11H,1-6H2,16H3;4*6-8H,1-5H2,13H3;5-7H,1-4H2,13H3;5-6,8H,1-4H2,13H3;2*5-7H,1-4H2,13H3;2*4-8H,1-3H2,12H3;2*3-7H,1-2H2,12H3
InChIKeyKNWAXAGPUKPISA-UHFFFAOYSA-N
XLogP0.74
TPSA469.73 Ų
H-Bond Donors
H-Bond Acceptors39
Rotatable Bonds13
Heavy Atoms202
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5003062.78
LogP ≤ 50.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1039

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze [6-[(3-ethyloxetan-3-yl)methoxymethyl]-7-oxabicyclo[2.2.1]heptan-2-yl]silane;8-silyl-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;9-silyl-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;8-silyl-4-oxatricyclo[5.2.1.02,6]decan-3-one;9-silyl-4-oxatricyclo[5.2.1.02,6]decan-3-one;9-(3-silylpropoxy)-4-oxatricyclo[5.2.1.02,6]decan-3-one;6-(3-silylpropoxy)spiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[bicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-silylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-silylspiro[bicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;5-silylspiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-silylspiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-silylspiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of [6-[(3-ethyloxetan-3-yl)methoxymethyl]-7-oxabicyclo[2.2.1]heptan-2-yl]silane;8-silyl-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;9-silyl-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;8-silyl-4-oxatricyclo[5.2.1.02,6]decan-3-one;9-silyl-4-oxatricyclo[5.2.1.02,6]decan-3-one;9-(3-silylpropoxy)-4-oxatricyclo[5.2.1.02,6]decan-3-one;6-(3-silylpropoxy)spiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[bicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-silylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-silylspiro[bicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;5-silylspiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-silylspiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-silylspiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one?
The IUPAC name of [6-[(3-ethyloxetan-3-yl)methoxymethyl]-7-oxabicyclo[2.2.1]heptan-2-yl]silane;8-silyl-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;9-silyl-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;8-silyl-4-oxatricyclo[5.2.1.02,6]decan-3-one;9-silyl-4-oxatricyclo[5.2.1.02,6]decan-3-one;9-(3-silylpropoxy)-4-oxatricyclo[5.2.1.02,6]decan-3-one;6-(3-silylpropoxy)spiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[bicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-silylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-silylspiro[bicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;5-silylspiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-silylspiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-silylspiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one (CID 159189123) is [6-[(3-ethyloxetan-3-yl)methoxymethyl]-7-oxabicyclo[2.2.1]heptan-2-yl]silane;8-silyl-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;9-silyl-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;8-silyl-4-oxatricyclo[5.2.1.02,6]decan-3-one;9-silyl-4-oxatricyclo[5.2.1.02,6]decan-3-one;9-(3-silylpropoxy)-4-oxatricyclo[5.2.1.02,6]decan-3-one;6-(3-silylpropoxy)spiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[bicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-silylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-silylspiro[bicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;5-silylspiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-silylspiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-silylspiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one.
What is the SMILES notation for [6-[(3-ethyloxetan-3-yl)methoxymethyl]-7-oxabicyclo[2.2.1]heptan-2-yl]silane;8-silyl-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;9-silyl-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;8-silyl-4-oxatricyclo[5.2.1.02,6]decan-3-one;9-silyl-4-oxatricyclo[5.2.1.02,6]decan-3-one;9-(3-silylpropoxy)-4-oxatricyclo[5.2.1.02,6]decan-3-one;6-(3-silylpropoxy)spiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[bicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-silylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-silylspiro[bicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;5-silylspiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-silylspiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-silylspiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one?
The canonical SMILES for [6-[(3-ethyloxetan-3-yl)methoxymethyl]-7-oxabicyclo[2.2.1]heptan-2-yl]silane;8-silyl-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;9-silyl-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;8-silyl-4-oxatricyclo[5.2.1.02,6]decan-3-one;9-silyl-4-oxatricyclo[5.2.1.02,6]decan-3-one;9-(3-silylpropoxy)-4-oxatricyclo[5.2.1.02,6]decan-3-one;6-(3-silylpropoxy)spiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[bicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-silylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-silylspiro[bicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;5-silylspiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-silylspiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-silylspiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one is CCC1(COCC2CC3CC([SiH3])C2O3)COC1.O=C1CC2(CO1)CC1CC([SiH3])C2C1.O=C1CC2(CO1)CC1CC([SiH3])C2O1.O=C1CC2(CO1)CC1CC2CC1[SiH3].O=C1CC2(CO1)CC1OC2CC1[SiH3].O=C1OCC2C3CC(CC3[SiH3])C12.O=C1OCC2C3CC(OCCC[SiH3])C(C3)C12.O=C1OCC2C3CC([SiH3])C(C3)C12.O=C1OCC2C3CC([SiH3])C(O3)C12.O=C1OCC2C3OC(CC3[SiH3])C12.O=C1OCCC12CC1CC(OCCC[SiH3])C2C1.O=C1OCCC12CC1CC([SiH3])C2C1.O=C1OCCC12CC1CC([SiH3])C2O1.O=C1OCCC12CC1CC2CC1[SiH3].O=C1OCCC12CC1OC2CC1[SiH3].
What is the InChIKey of [6-[(3-ethyloxetan-3-yl)methoxymethyl]-7-oxabicyclo[2.2.1]heptan-2-yl]silane;8-silyl-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;9-silyl-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;8-silyl-4-oxatricyclo[5.2.1.02,6]decan-3-one;9-silyl-4-oxatricyclo[5.2.1.02,6]decan-3-one;9-(3-silylpropoxy)-4-oxatricyclo[5.2.1.02,6]decan-3-one;6-(3-silylpropoxy)spiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[bicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-silylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-silylspiro[bicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;5-silylspiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-silylspiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-silylspiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one?
The InChIKey is KNWAXAGPUKPISA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22O3Si.C13H24O3Si.C12H20O3Si.4C10H16O2Si.4C9H14O3Si.2C9H14O2Si.2C8H12O3Si/c14-12-13(2-4-16-12)8-9-6-10(13)11(7-9)15-3-1-5-17;1-2-13(7-15-8-13)6-14-5-9-3-10-4-11(17)12(9)16-10;13-12-11-8-4-7(9(11)6-15-12)5-10(8)14-2-1-3-16;11-9-4-10(5-12-9)3-6-1-7(10)2-8(6)13;11-9-4-10(5-12-9)3-6-1-7(10)8(13)2-6;11-9-10(1-2-12-9)5-6-3-7(10)4-8(6)13;11-9-10(1-2-12-9)5-6-3-7(10)8(13)4-6;10-8-3-9(4-11-8)2-5-6(13)1-7(9)12-5;10-7-3-9(4-11-7)2-5-1-6(13)8(9)12-5;10-8-9(1-2-11-8)4-5-6(13)3-7(9)12-5;10-8-9(1-2-11-8)4-5-3-6(13)7(9)12-5;10-9-8-4-1-5(7(12)2-4)6(8)3-11-9;10-9-8-5-1-4(2-7(5)12)6(8)3-11-9;9-8-6-3(2-10-8)7-5(12)1-4(6)11-7;9-8-6-3(2-10-8)4-1-5(12)7(6)11-4/h9-11H,1-8H2,17H3;9-12H,2-8H2,1,17H3;7-11H,1-6H2,16H3;4*6-8H,1-5H2,13H3;5-7H,1-4H2,13H3;5-6,8H,1-4H2,13H3;2*5-7H,1-4H2,13H3;2*4-8H,1-3H2,12H3;2*3-7H,1-2H2,12H3.
What are the key properties of [6-[(3-ethyloxetan-3-yl)methoxymethyl]-7-oxabicyclo[2.2.1]heptan-2-yl]silane;8-silyl-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;9-silyl-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;8-silyl-4-oxatricyclo[5.2.1.02,6]decan-3-one;9-silyl-4-oxatricyclo[5.2.1.02,6]decan-3-one;9-(3-silylpropoxy)-4-oxatricyclo[5.2.1.02,6]decan-3-one;6-(3-silylpropoxy)spiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[bicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-silylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-silylspiro[bicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;5-silylspiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-silylspiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-silylspiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one?
[6-[(3-ethyloxetan-3-yl)methoxymethyl]-7-oxabicyclo[2.2.1]heptan-2-yl]silane;8-silyl-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;9-silyl-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;8-silyl-4-oxatricyclo[5.2.1.02,6]decan-3-one;9-silyl-4-oxatricyclo[5.2.1.02,6]decan-3-one;9-(3-silylpropoxy)-4-oxatricyclo[5.2.1.02,6]decan-3-one;6-(3-silylpropoxy)spiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[bicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-silylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-silylspiro[bicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;5-silylspiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-silylspiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-silylspiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one has a molecular weight of 3062.78 g/mol, XLogP of 0.74, 13 rotatable bonds, 0 hydrogen bond donors, and 39 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[(3-ethyloxetan-3-yl)methoxymethyl]-7-oxabicyclo[2.2.1]heptan-2-yl]silane;8-silyl-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;9-silyl-4,10-dioxatricyclo[5.2.1.02,6]decan-3-one;8-silyl-4-oxatricyclo[5.2.1.02,6]decan-3-one;9-silyl-4-oxatricyclo[5.2.1.02,6]decan-3-one;9-(3-silylpropoxy)-4-oxatricyclo[5.2.1.02,6]decan-3-one;6-(3-silylpropoxy)spiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[bicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-silylspiro[bicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-silylspiro[bicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;5-silylspiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;5-silylspiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one;6-silylspiro[7-oxabicyclo[2.2.1]heptane-2,3'-oxolane]-2'-one;6-silylspiro[7-oxabicyclo[2.2.1]heptane-2,4'-oxolane]-2'-one is sourced from PubChem (CID 159189123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).