trimethyl-[1,2,4,4,7-pentakis(trimethylsilyl)-1,2,3-trisilaspiro[2.4]hept-1-en-7-yl]silane

C22H58Si9 — CID 102083529

IUPACtrimethyl-[1,2,4,4,7-pentakis(trimethylsilyl)-1,2,3-trisilaspiro[2.4]hept-1-en-7-yl]silane
SMILESC[Si](C)(C)[Si]1=[Si]([Si](C)(C)C)[Si]12C([Si](C)(C)C)([Si](C)(C)C)CCC2([Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C22H58Si9/c1-25(2,3)21(26(4,5)6)19-20-22(27(7,8)9,28(10,11)12)31(21)23(29(13,14)15)24(31)30(16,17)18/h19-20H2,1-18H3
InChIKeyOWPIGHGELBJJTN-UHFFFAOYSA-N
MW575.48 g/mol
LogP8.29
Rot. Bonds6

About trimethyl-[1,2,4,4,7-pentakis(trimethylsilyl)-1,2,3-trisilaspiro[2.4]hept-1-en-7-yl]silane

trimethyl-[1,2,4,4,7-pentakis(trimethylsilyl)-1,2,3-trisilaspiro[2.4]hept-1-en-7-yl]silane (PubChem CID 102083529) has the molecular formula C22H58Si9 and a molecular weight of 575.48 g/mol. Its IUPAC name is trimethyl-[1,2,4,4,7-pentakis(trimethylsilyl)-1,2,3-trisilaspiro[2.4]hept-1-en-7-yl]silane.

Molecular Properties

Compound Nametrimethyl-[1,2,4,4,7-pentakis(trimethylsilyl)-1,2,3-trisilaspiro[2.4]hept-1-en-7-yl]silane
PubChem CID102083529
Molecular FormulaC22H58Si9
Molecular Weight575.48 g/mol
Exact Mass574.25
IUPAC Nametrimethyl-[1,2,4,4,7-pentakis(trimethylsilyl)-1,2,3-trisilaspiro[2.4]hept-1-en-7-yl]silane
SMILESC[Si](C)(C)[Si]1=[Si]([Si](C)(C)C)[Si]12C([Si](C)(C)C)([Si](C)(C)C)CCC2([Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C22H58Si9/c1-25(2,3)21(26(4,5)6)19-20-22(27(7,8)9,28(10,11)12)31(21)23(29(13,14)15)24(31)30(16,17)18/h19-20H2,1-18H3
InChIKeyOWPIGHGELBJJTN-UHFFFAOYSA-N
XLogP8.29
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500575.48
LogP ≤ 58.29
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 trimethyl-[1,2,4,4,7-pentakis(trimethylsilyl)-1,2,3-trisilaspiro[2.4]hept-1-en-7-yl]silane?
The IUPAC name of trimethyl-[1,2,4,4,7-pentakis(trimethylsilyl)-1,2,3-trisilaspiro[2.4]hept-1-en-7-yl]silane (CID 102083529) is trimethyl-[1,2,4,4,7-pentakis(trimethylsilyl)-1,2,3-trisilaspiro[2.4]hept-1-en-7-yl]silane.
What is the SMILES notation for trimethyl-[1,2,4,4,7-pentakis(trimethylsilyl)-1,2,3-trisilaspiro[2.4]hept-1-en-7-yl]silane?
The canonical SMILES for trimethyl-[1,2,4,4,7-pentakis(trimethylsilyl)-1,2,3-trisilaspiro[2.4]hept-1-en-7-yl]silane is C[Si](C)(C)[Si]1=[Si]([Si](C)(C)C)[Si]12C([Si](C)(C)C)([Si](C)(C)C)CCC2([Si](C)(C)C)[Si](C)(C)C.
What is the InChIKey of trimethyl-[1,2,4,4,7-pentakis(trimethylsilyl)-1,2,3-trisilaspiro[2.4]hept-1-en-7-yl]silane?
The InChIKey is OWPIGHGELBJJTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H58Si9/c1-25(2,3)21(26(4,5)6)19-20-22(27(7,8)9,28(10,11)12)31(21)23(29(13,14)15)24(31)30(16,17)18/h19-20H2,1-18H3.
What are the key properties of trimethyl-[1,2,4,4,7-pentakis(trimethylsilyl)-1,2,3-trisilaspiro[2.4]hept-1-en-7-yl]silane?
trimethyl-[1,2,4,4,7-pentakis(trimethylsilyl)-1,2,3-trisilaspiro[2.4]hept-1-en-7-yl]silane has a molecular weight of 575.48 g/mol, XLogP of 8.29, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[1,2,4,4,7-pentakis(trimethylsilyl)-1,2,3-trisilaspiro[2.4]hept-1-en-7-yl]silane is sourced from PubChem (CID 102083529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).