[1,2,2,3,3,4,4-heptakis(trimethylsilyl)tetrasiletan-1-yl]-trimethylsilane

C24H72Si12 — CID 12793745

IUPAC[1,2,2,3,3,4,4-heptakis(trimethylsilyl)tetrasiletan-1-yl]-trimethylsilane
SMILESC[Si](C)(C)[Si]1([Si](C)(C)C)[Si]([Si](C)(C)C)([Si](C)(C)C)[Si]([Si](C)(C)C)([Si](C)(C)C)[Si]1([Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C24H72Si12/c1-25(2,3)33(26(4,5)6)34(27(7,8)9,28(10,11)12)36(31(19,20)21,32(22,23)24)35(33,29(13,14)15)30(16,17)18/h1-24H3
InChIKeyJPXGMXXVGJYDKK-UHFFFAOYSA-N
MW697.87 g/mol
LogP9.44
Rot. Bonds8

About [1,2,2,3,3,4,4-heptakis(trimethylsilyl)tetrasiletan-1-yl]-trimethylsilane

[1,2,2,3,3,4,4-heptakis(trimethylsilyl)tetrasiletan-1-yl]-trimethylsilane (PubChem CID 12793745) has the molecular formula C24H72Si12 and a molecular weight of 697.87 g/mol. Its IUPAC name is [1,2,2,3,3,4,4-heptakis(trimethylsilyl)tetrasiletan-1-yl]-trimethylsilane.

Molecular Properties

Compound Name[1,2,2,3,3,4,4-heptakis(trimethylsilyl)tetrasiletan-1-yl]-trimethylsilane
PubChem CID12793745
Molecular FormulaC24H72Si12
Molecular Weight697.87 g/mol
Exact Mass696.29
IUPAC Name[1,2,2,3,3,4,4-heptakis(trimethylsilyl)tetrasiletan-1-yl]-trimethylsilane
SMILESC[Si](C)(C)[Si]1([Si](C)(C)C)[Si]([Si](C)(C)C)([Si](C)(C)C)[Si]([Si](C)(C)C)([Si](C)(C)C)[Si]1([Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C24H72Si12/c1-25(2,3)33(26(4,5)6)34(27(7,8)9,28(10,11)12)36(31(19,20)21,32(22,23)24)35(33,29(13,14)15)30(16,17)18/h1-24H3
InChIKeyJPXGMXXVGJYDKK-UHFFFAOYSA-N
XLogP9.44
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms36
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500697.87
LogP ≤ 59.44
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 [1,2,2,3,3,4,4-heptakis(trimethylsilyl)tetrasiletan-1-yl]-trimethylsilane?
The IUPAC name of [1,2,2,3,3,4,4-heptakis(trimethylsilyl)tetrasiletan-1-yl]-trimethylsilane (CID 12793745) is [1,2,2,3,3,4,4-heptakis(trimethylsilyl)tetrasiletan-1-yl]-trimethylsilane.
What is the SMILES notation for [1,2,2,3,3,4,4-heptakis(trimethylsilyl)tetrasiletan-1-yl]-trimethylsilane?
The canonical SMILES for [1,2,2,3,3,4,4-heptakis(trimethylsilyl)tetrasiletan-1-yl]-trimethylsilane is C[Si](C)(C)[Si]1([Si](C)(C)C)[Si]([Si](C)(C)C)([Si](C)(C)C)[Si]([Si](C)(C)C)([Si](C)(C)C)[Si]1([Si](C)(C)C)[Si](C)(C)C.
What is the InChIKey of [1,2,2,3,3,4,4-heptakis(trimethylsilyl)tetrasiletan-1-yl]-trimethylsilane?
The InChIKey is JPXGMXXVGJYDKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H72Si12/c1-25(2,3)33(26(4,5)6)34(27(7,8)9,28(10,11)12)36(31(19,20)21,32(22,23)24)35(33,29(13,14)15)30(16,17)18/h1-24H3.
What are the key properties of [1,2,2,3,3,4,4-heptakis(trimethylsilyl)tetrasiletan-1-yl]-trimethylsilane?
[1,2,2,3,3,4,4-heptakis(trimethylsilyl)tetrasiletan-1-yl]-trimethylsilane has a molecular weight of 697.87 g/mol, XLogP of 9.44, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [1,2,2,3,3,4,4-heptakis(trimethylsilyl)tetrasiletan-1-yl]-trimethylsilane is sourced from PubChem (CID 12793745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).