[6-tert-butyl-4-methyl-1,1-bis(trimethylsilyl)-2,5-dihydrosilin-6-yl]oxy-trimethylsilane

C19H44OSi4 — CID 101354289

IUPAC[6-tert-butyl-4-methyl-1,1-bis(trimethylsilyl)-2,5-dihydrosilin-6-yl]oxy-trimethylsilane
SMILESCC1=CC[Si]([Si](C)(C)C)([Si](C)(C)C)C(O[Si](C)(C)C)(C(C)(C)C)C1
InChIInChI=1S/C19H44OSi4/c1-17-14-15-24(22(8,9)10,23(11,12)13)19(16-17,18(2,3)4)20-21(5,6)7/h14H,15-16H2,1-13H3
InChIKeyCQVIHACZYQGHMR-UHFFFAOYSA-N
MW400.90 g/mol
LogP6.79
Rot. Bonds4

About [6-tert-butyl-4-methyl-1,1-bis(trimethylsilyl)-2,5-dihydrosilin-6-yl]oxy-trimethylsilane

[6-tert-butyl-4-methyl-1,1-bis(trimethylsilyl)-2,5-dihydrosilin-6-yl]oxy-trimethylsilane (PubChem CID 101354289) has the molecular formula C19H44OSi4 and a molecular weight of 400.90 g/mol. Its IUPAC name is [6-tert-butyl-4-methyl-1,1-bis(trimethylsilyl)-2,5-dihydrosilin-6-yl]oxy-trimethylsilane.

Molecular Properties

Compound Name[6-tert-butyl-4-methyl-1,1-bis(trimethylsilyl)-2,5-dihydrosilin-6-yl]oxy-trimethylsilane
PubChem CID101354289
Molecular FormulaC19H44OSi4
Molecular Weight400.90 g/mol
Exact Mass400.25
IUPAC Name[6-tert-butyl-4-methyl-1,1-bis(trimethylsilyl)-2,5-dihydrosilin-6-yl]oxy-trimethylsilane
SMILESCC1=CC[Si]([Si](C)(C)C)([Si](C)(C)C)C(O[Si](C)(C)C)(C(C)(C)C)C1
InChIInChI=1S/C19H44OSi4/c1-17-14-15-24(22(8,9)10,23(11,12)13)19(16-17,18(2,3)4)20-21(5,6)7/h14H,15-16H2,1-13H3
InChIKeyCQVIHACZYQGHMR-UHFFFAOYSA-N
XLogP6.79
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500400.90
LogP ≤ 56.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 [6-tert-butyl-4-methyl-1,1-bis(trimethylsilyl)-2,5-dihydrosilin-6-yl]oxy-trimethylsilane?
The IUPAC name of [6-tert-butyl-4-methyl-1,1-bis(trimethylsilyl)-2,5-dihydrosilin-6-yl]oxy-trimethylsilane (CID 101354289) is [6-tert-butyl-4-methyl-1,1-bis(trimethylsilyl)-2,5-dihydrosilin-6-yl]oxy-trimethylsilane.
What is the SMILES notation for [6-tert-butyl-4-methyl-1,1-bis(trimethylsilyl)-2,5-dihydrosilin-6-yl]oxy-trimethylsilane?
The canonical SMILES for [6-tert-butyl-4-methyl-1,1-bis(trimethylsilyl)-2,5-dihydrosilin-6-yl]oxy-trimethylsilane is CC1=CC[Si]([Si](C)(C)C)([Si](C)(C)C)C(O[Si](C)(C)C)(C(C)(C)C)C1.
What is the InChIKey of [6-tert-butyl-4-methyl-1,1-bis(trimethylsilyl)-2,5-dihydrosilin-6-yl]oxy-trimethylsilane?
The InChIKey is CQVIHACZYQGHMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H44OSi4/c1-17-14-15-24(22(8,9)10,23(11,12)13)19(16-17,18(2,3)4)20-21(5,6)7/h14H,15-16H2,1-13H3.
What are the key properties of [6-tert-butyl-4-methyl-1,1-bis(trimethylsilyl)-2,5-dihydrosilin-6-yl]oxy-trimethylsilane?
[6-tert-butyl-4-methyl-1,1-bis(trimethylsilyl)-2,5-dihydrosilin-6-yl]oxy-trimethylsilane has a molecular weight of 400.90 g/mol, XLogP of 6.79, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [6-tert-butyl-4-methyl-1,1-bis(trimethylsilyl)-2,5-dihydrosilin-6-yl]oxy-trimethylsilane is sourced from PubChem (CID 101354289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).