trimethyl-[1,1,4,6,6-pentakis(trimethylsilyl)hexa-1,2,4,5-tetraen-3-yl]silane

C24H54Si6 — CID 5097630

IUPACtrimethyl-[1,1,4,6,6-pentakis(trimethylsilyl)hexa-1,2,4,5-tetraen-3-yl]silane
SMILESC[Si](C)(C)C(=C=C([Si](C)(C)C)[Si](C)(C)C)C(=C=C([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C24H54Si6/c1-25(2,3)21(19-23(27(7,8)9)28(10,11)12)22(26(4,5)6)20-24(29(13,14)15)30(16,17)18/h1-18H3
InChIKeyZGWHURGNNFKCKU-UHFFFAOYSA-N
MW511.21 g/mol
LogP9.15
Rot. Bonds7

About trimethyl-[1,1,4,6,6-pentakis(trimethylsilyl)hexa-1,2,4,5-tetraen-3-yl]silane

trimethyl-[1,1,4,6,6-pentakis(trimethylsilyl)hexa-1,2,4,5-tetraen-3-yl]silane (PubChem CID 5097630) has the molecular formula C24H54Si6 and a molecular weight of 511.21 g/mol. Its IUPAC name is trimethyl-[1,1,4,6,6-pentakis(trimethylsilyl)hexa-1,2,4,5-tetraen-3-yl]silane.

Molecular Properties

Compound Nametrimethyl-[1,1,4,6,6-pentakis(trimethylsilyl)hexa-1,2,4,5-tetraen-3-yl]silane
PubChem CID5097630
Molecular FormulaC24H54Si6
Molecular Weight511.21 g/mol
Exact Mass510.28
IUPAC Nametrimethyl-[1,1,4,6,6-pentakis(trimethylsilyl)hexa-1,2,4,5-tetraen-3-yl]silane
SMILESC[Si](C)(C)C(=C=C([Si](C)(C)C)[Si](C)(C)C)C(=C=C([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C24H54Si6/c1-25(2,3)21(19-23(27(7,8)9)28(10,11)12)22(26(4,5)6)20-24(29(13,14)15)30(16,17)18/h1-18H3
InChIKeyZGWHURGNNFKCKU-UHFFFAOYSA-N
XLogP9.15
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500511.21
LogP ≤ 59.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of trimethyl-[1,1,4,6,6-pentakis(trimethylsilyl)hexa-1,2,4,5-tetraen-3-yl]silane?
The IUPAC name of trimethyl-[1,1,4,6,6-pentakis(trimethylsilyl)hexa-1,2,4,5-tetraen-3-yl]silane (CID 5097630) is trimethyl-[1,1,4,6,6-pentakis(trimethylsilyl)hexa-1,2,4,5-tetraen-3-yl]silane.
What is the SMILES notation for trimethyl-[1,1,4,6,6-pentakis(trimethylsilyl)hexa-1,2,4,5-tetraen-3-yl]silane?
The canonical SMILES for trimethyl-[1,1,4,6,6-pentakis(trimethylsilyl)hexa-1,2,4,5-tetraen-3-yl]silane is C[Si](C)(C)C(=C=C([Si](C)(C)C)[Si](C)(C)C)C(=C=C([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C.
What is the InChIKey of trimethyl-[1,1,4,6,6-pentakis(trimethylsilyl)hexa-1,2,4,5-tetraen-3-yl]silane?
The InChIKey is ZGWHURGNNFKCKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H54Si6/c1-25(2,3)21(19-23(27(7,8)9)28(10,11)12)22(26(4,5)6)20-24(29(13,14)15)30(16,17)18/h1-18H3.
What are the key properties of trimethyl-[1,1,4,6,6-pentakis(trimethylsilyl)hexa-1,2,4,5-tetraen-3-yl]silane?
trimethyl-[1,1,4,6,6-pentakis(trimethylsilyl)hexa-1,2,4,5-tetraen-3-yl]silane has a molecular weight of 511.21 g/mol, XLogP of 9.15, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[1,1,4,6,6-pentakis(trimethylsilyl)hexa-1,2,4,5-tetraen-3-yl]silane is sourced from PubChem (CID 5097630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).