trimethyl-[[3-[6-[(2-methylpropan-2-yl)oxy]hexyl]-1H-inden-1-yl]methyl]silane

C23H38OSi — CID 178090504

IUPACtrimethyl-[[3-[6-[(2-methylpropan-2-yl)oxy]hexyl]-1H-inden-1-yl]methyl]silane
SMILESCC(C)(C)OCCCCCCC1=CC(C[Si](C)(C)C)c2ccccc21
InChIInChI=1S/C23H38OSi/c1-23(2,3)24-16-12-8-7-9-13-19-17-20(18-25(4,5)6)22-15-11-10-14-21(19)22/h10-11,14-15,17,20H,7-9,12-13,16,18H2,1-6H3
InChIKeyOSAZVPOZAZJLHW-UHFFFAOYSA-N
MW358.64 g/mol
LogP7.27
Rot. Bonds9

About trimethyl-[[3-[6-[(2-methylpropan-2-yl)oxy]hexyl]-1H-inden-1-yl]methyl]silane

trimethyl-[[3-[6-[(2-methylpropan-2-yl)oxy]hexyl]-1H-inden-1-yl]methyl]silane (PubChem CID 178090504) has the molecular formula C23H38OSi and a molecular weight of 358.64 g/mol. Its IUPAC name is trimethyl-[[3-[6-[(2-methylpropan-2-yl)oxy]hexyl]-1H-inden-1-yl]methyl]silane.

Molecular Properties

Compound Nametrimethyl-[[3-[6-[(2-methylpropan-2-yl)oxy]hexyl]-1H-inden-1-yl]methyl]silane
PubChem CID178090504
Molecular FormulaC23H38OSi
Molecular Weight358.64 g/mol
Exact Mass358.27
IUPAC Nametrimethyl-[[3-[6-[(2-methylpropan-2-yl)oxy]hexyl]-1H-inden-1-yl]methyl]silane
SMILESCC(C)(C)OCCCCCCC1=CC(C[Si](C)(C)C)c2ccccc21
InChIInChI=1S/C23H38OSi/c1-23(2,3)24-16-12-8-7-9-13-19-17-20(18-25(4,5)6)22-15-11-10-14-21(19)22/h10-11,14-15,17,20H,7-9,12-13,16,18H2,1-6H3
InChIKeyOSAZVPOZAZJLHW-UHFFFAOYSA-N
XLogP7.27
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500358.64
LogP ≤ 57.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of trimethyl-[[3-[6-[(2-methylpropan-2-yl)oxy]hexyl]-1H-inden-1-yl]methyl]silane?
The IUPAC name of trimethyl-[[3-[6-[(2-methylpropan-2-yl)oxy]hexyl]-1H-inden-1-yl]methyl]silane (CID 178090504) is trimethyl-[[3-[6-[(2-methylpropan-2-yl)oxy]hexyl]-1H-inden-1-yl]methyl]silane.
What is the SMILES notation for trimethyl-[[3-[6-[(2-methylpropan-2-yl)oxy]hexyl]-1H-inden-1-yl]methyl]silane?
The canonical SMILES for trimethyl-[[3-[6-[(2-methylpropan-2-yl)oxy]hexyl]-1H-inden-1-yl]methyl]silane is CC(C)(C)OCCCCCCC1=CC(C[Si](C)(C)C)c2ccccc21.
What is the InChIKey of trimethyl-[[3-[6-[(2-methylpropan-2-yl)oxy]hexyl]-1H-inden-1-yl]methyl]silane?
The InChIKey is OSAZVPOZAZJLHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H38OSi/c1-23(2,3)24-16-12-8-7-9-13-19-17-20(18-25(4,5)6)22-15-11-10-14-21(19)22/h10-11,14-15,17,20H,7-9,12-13,16,18H2,1-6H3.
What are the key properties of trimethyl-[[3-[6-[(2-methylpropan-2-yl)oxy]hexyl]-1H-inden-1-yl]methyl]silane?
trimethyl-[[3-[6-[(2-methylpropan-2-yl)oxy]hexyl]-1H-inden-1-yl]methyl]silane has a molecular weight of 358.64 g/mol, XLogP of 7.27, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[[3-[6-[(2-methylpropan-2-yl)oxy]hexyl]-1H-inden-1-yl]methyl]silane is sourced from PubChem (CID 178090504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).