tri(propan-2-yl)-[[7-tri(propan-2-yl)silyloxy-3a,4,5,6,7,7a-hexahydro-1H-inden-4-yl]oxy]silane

C27H54O2Si2 — CID 58666146

IUPACtri(propan-2-yl)-[[7-tri(propan-2-yl)silyloxy-3a,4,5,6,7,7a-hexahydro-1H-inden-4-yl]oxy]silane
SMILESCC(C)[Si](OC1CCC(O[Si](C(C)C)(C(C)C)C(C)C)C2CC=CC12)(C(C)C)C(C)C
InChIInChI=1S/C27H54O2Si2/c1-18(2)30(19(3)4,20(5)6)28-26-16-17-27(25-15-13-14-24(25)26)29-31(21(7)8,22(9)10)23(11)12/h13-14,18-27H,15-17H2,1-12H3
InChIKeyOBIZSVIWOIBNFP-UHFFFAOYSA-N
MW466.90 g/mol
LogP9.09
Rot. Bonds10

About tri(propan-2-yl)-[[7-tri(propan-2-yl)silyloxy-3a,4,5,6,7,7a-hexahydro-1H-inden-4-yl]oxy]silane

tri(propan-2-yl)-[[7-tri(propan-2-yl)silyloxy-3a,4,5,6,7,7a-hexahydro-1H-inden-4-yl]oxy]silane (PubChem CID 58666146) has the molecular formula C27H54O2Si2 and a molecular weight of 466.90 g/mol. Its IUPAC name is tri(propan-2-yl)-[[7-tri(propan-2-yl)silyloxy-3a,4,5,6,7,7a-hexahydro-1H-inden-4-yl]oxy]silane.

Molecular Properties

Compound Nametri(propan-2-yl)-[[7-tri(propan-2-yl)silyloxy-3a,4,5,6,7,7a-hexahydro-1H-inden-4-yl]oxy]silane
PubChem CID58666146
Molecular FormulaC27H54O2Si2
Molecular Weight466.90 g/mol
Exact Mass466.37
IUPAC Nametri(propan-2-yl)-[[7-tri(propan-2-yl)silyloxy-3a,4,5,6,7,7a-hexahydro-1H-inden-4-yl]oxy]silane
SMILESCC(C)[Si](OC1CCC(O[Si](C(C)C)(C(C)C)C(C)C)C2CC=CC12)(C(C)C)C(C)C
InChIInChI=1S/C27H54O2Si2/c1-18(2)30(19(3)4,20(5)6)28-26-16-17-27(25-15-13-14-24(25)26)29-31(21(7)8,22(9)10)23(11)12/h13-14,18-27H,15-17H2,1-12H3
InChIKeyOBIZSVIWOIBNFP-UHFFFAOYSA-N
XLogP9.09
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500466.90
LogP ≤ 59.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of tri(propan-2-yl)-[[7-tri(propan-2-yl)silyloxy-3a,4,5,6,7,7a-hexahydro-1H-inden-4-yl]oxy]silane?
The IUPAC name of tri(propan-2-yl)-[[7-tri(propan-2-yl)silyloxy-3a,4,5,6,7,7a-hexahydro-1H-inden-4-yl]oxy]silane (CID 58666146) is tri(propan-2-yl)-[[7-tri(propan-2-yl)silyloxy-3a,4,5,6,7,7a-hexahydro-1H-inden-4-yl]oxy]silane.
What is the SMILES notation for tri(propan-2-yl)-[[7-tri(propan-2-yl)silyloxy-3a,4,5,6,7,7a-hexahydro-1H-inden-4-yl]oxy]silane?
The canonical SMILES for tri(propan-2-yl)-[[7-tri(propan-2-yl)silyloxy-3a,4,5,6,7,7a-hexahydro-1H-inden-4-yl]oxy]silane is CC(C)[Si](OC1CCC(O[Si](C(C)C)(C(C)C)C(C)C)C2CC=CC12)(C(C)C)C(C)C.
What is the InChIKey of tri(propan-2-yl)-[[7-tri(propan-2-yl)silyloxy-3a,4,5,6,7,7a-hexahydro-1H-inden-4-yl]oxy]silane?
The InChIKey is OBIZSVIWOIBNFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H54O2Si2/c1-18(2)30(19(3)4,20(5)6)28-26-16-17-27(25-15-13-14-24(25)26)29-31(21(7)8,22(9)10)23(11)12/h13-14,18-27H,15-17H2,1-12H3.
What are the key properties of tri(propan-2-yl)-[[7-tri(propan-2-yl)silyloxy-3a,4,5,6,7,7a-hexahydro-1H-inden-4-yl]oxy]silane?
tri(propan-2-yl)-[[7-tri(propan-2-yl)silyloxy-3a,4,5,6,7,7a-hexahydro-1H-inden-4-yl]oxy]silane has a molecular weight of 466.90 g/mol, XLogP of 9.09, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tri(propan-2-yl)-[[7-tri(propan-2-yl)silyloxy-3a,4,5,6,7,7a-hexahydro-1H-inden-4-yl]oxy]silane is sourced from PubChem (CID 58666146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).