sodium;ethyl-tris(1H-inden-1-yl)silane;hydride

C29H27NaSi — CID 173341376

IUPACsodium;ethyl-tris(1H-inden-1-yl)silane;hydride
SMILESCC[Si](C1C=Cc2ccccc21)(C1C=Cc2ccccc21)C1C=Cc2ccccc21.[H-].[Na+]
InChIInChI=1S/C29H26Si.Na.H/c1-2-30(27-18-15-21-9-3-6-12-24(21)27,28-19-16-22-10-4-7-13-25(22)28)29-20-17-23-11-5-8-14-26(23)29;;/h3-20,27-29H,2H2,1H3;;/q;+1;-1
InChIKeyXKEWUKPKSJZAJE-UHFFFAOYSA-N
MW426.61 g/mol
LogP4.62
Rot. Bonds4

About sodium;ethyl-tris(1H-inden-1-yl)silane;hydride

sodium;ethyl-tris(1H-inden-1-yl)silane;hydride (PubChem CID 173341376) has the molecular formula C29H27NaSi and a molecular weight of 426.61 g/mol. Its IUPAC name is sodium;ethyl-tris(1H-inden-1-yl)silane;hydride.

Molecular Properties

Compound Namesodium;ethyl-tris(1H-inden-1-yl)silane;hydride
PubChem CID173341376
Molecular FormulaC29H27NaSi
Molecular Weight426.61 g/mol
Exact Mass426.18
IUPAC Namesodium;ethyl-tris(1H-inden-1-yl)silane;hydride
SMILESCC[Si](C1C=Cc2ccccc21)(C1C=Cc2ccccc21)C1C=Cc2ccccc21.[H-].[Na+]
InChIInChI=1S/C29H26Si.Na.H/c1-2-30(27-18-15-21-9-3-6-12-24(21)27,28-19-16-22-10-4-7-13-25(22)28)29-20-17-23-11-5-8-14-26(23)29;;/h3-20,27-29H,2H2,1H3;;/q;+1;-1
InChIKeyXKEWUKPKSJZAJE-UHFFFAOYSA-N
XLogP4.62
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500426.61
LogP ≤ 54.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of sodium;ethyl-tris(1H-inden-1-yl)silane;hydride?
The IUPAC name of sodium;ethyl-tris(1H-inden-1-yl)silane;hydride (CID 173341376) is sodium;ethyl-tris(1H-inden-1-yl)silane;hydride.
What is the SMILES notation for sodium;ethyl-tris(1H-inden-1-yl)silane;hydride?
The canonical SMILES for sodium;ethyl-tris(1H-inden-1-yl)silane;hydride is CC[Si](C1C=Cc2ccccc21)(C1C=Cc2ccccc21)C1C=Cc2ccccc21.[H-].[Na+].
What is the InChIKey of sodium;ethyl-tris(1H-inden-1-yl)silane;hydride?
The InChIKey is XKEWUKPKSJZAJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H26Si.Na.H/c1-2-30(27-18-15-21-9-3-6-12-24(21)27,28-19-16-22-10-4-7-13-25(22)28)29-20-17-23-11-5-8-14-26(23)29;;/h3-20,27-29H,2H2,1H3;;/q;+1;-1.
What are the key properties of sodium;ethyl-tris(1H-inden-1-yl)silane;hydride?
sodium;ethyl-tris(1H-inden-1-yl)silane;hydride has a molecular weight of 426.61 g/mol, XLogP of 4.62, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;ethyl-tris(1H-inden-1-yl)silane;hydride is sourced from PubChem (CID 173341376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).