triethyl-[(5-triethylsilyloxy-3,4-dihydroinden-5-yl)oxy]silane

C21H38O2Si2 — CID 91367852

IUPACtriethyl-[(5-triethylsilyloxy-3,4-dihydroinden-5-yl)oxy]silane
SMILESCC[Si](CC)(CC)OC1(O[Si](CC)(CC)CC)C=CC2=C(CC=C2)C1
InChIInChI=1S/C21H38O2Si2/c1-7-24(8-2,9-3)22-21(23-25(10-4,11-5)12-6)17-16-19-14-13-15-20(19)18-21/h13-14,16-17H,7-12,15,18H2,1-6H3
InChIKeyJXXVPCOHMUSMJL-UHFFFAOYSA-N
MW378.71 g/mol
LogP6.94
Rot. Bonds10

About triethyl-[(5-triethylsilyloxy-3,4-dihydroinden-5-yl)oxy]silane

triethyl-[(5-triethylsilyloxy-3,4-dihydroinden-5-yl)oxy]silane (PubChem CID 91367852) has the molecular formula C21H38O2Si2 and a molecular weight of 378.71 g/mol. Its IUPAC name is triethyl-[(5-triethylsilyloxy-3,4-dihydroinden-5-yl)oxy]silane.

Molecular Properties

Compound Nametriethyl-[(5-triethylsilyloxy-3,4-dihydroinden-5-yl)oxy]silane
PubChem CID91367852
Molecular FormulaC21H38O2Si2
Molecular Weight378.71 g/mol
Exact Mass378.24
IUPAC Nametriethyl-[(5-triethylsilyloxy-3,4-dihydroinden-5-yl)oxy]silane
SMILESCC[Si](CC)(CC)OC1(O[Si](CC)(CC)CC)C=CC2=C(CC=C2)C1
InChIInChI=1S/C21H38O2Si2/c1-7-24(8-2,9-3)22-21(23-25(10-4,11-5)12-6)17-16-19-14-13-15-20(19)18-21/h13-14,16-17H,7-12,15,18H2,1-6H3
InChIKeyJXXVPCOHMUSMJL-UHFFFAOYSA-N
XLogP6.94
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500378.71
LogP ≤ 56.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of triethyl-[(5-triethylsilyloxy-3,4-dihydroinden-5-yl)oxy]silane?
The IUPAC name of triethyl-[(5-triethylsilyloxy-3,4-dihydroinden-5-yl)oxy]silane (CID 91367852) is triethyl-[(5-triethylsilyloxy-3,4-dihydroinden-5-yl)oxy]silane.
What is the SMILES notation for triethyl-[(5-triethylsilyloxy-3,4-dihydroinden-5-yl)oxy]silane?
The canonical SMILES for triethyl-[(5-triethylsilyloxy-3,4-dihydroinden-5-yl)oxy]silane is CC[Si](CC)(CC)OC1(O[Si](CC)(CC)CC)C=CC2=C(CC=C2)C1.
What is the InChIKey of triethyl-[(5-triethylsilyloxy-3,4-dihydroinden-5-yl)oxy]silane?
The InChIKey is JXXVPCOHMUSMJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H38O2Si2/c1-7-24(8-2,9-3)22-21(23-25(10-4,11-5)12-6)17-16-19-14-13-15-20(19)18-21/h13-14,16-17H,7-12,15,18H2,1-6H3.
What are the key properties of triethyl-[(5-triethylsilyloxy-3,4-dihydroinden-5-yl)oxy]silane?
triethyl-[(5-triethylsilyloxy-3,4-dihydroinden-5-yl)oxy]silane has a molecular weight of 378.71 g/mol, XLogP of 6.94, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-[(5-triethylsilyloxy-3,4-dihydroinden-5-yl)oxy]silane is sourced from PubChem (CID 91367852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).