bis[3,4-bis(trimethylsilyl)cyclopenta-2,4-dien-1-yl]-dimethylsilane

C24H48Si5 — CID 12979789

IUPACbis[3,4-bis(trimethylsilyl)cyclopenta-2,4-dien-1-yl]-dimethylsilane
SMILESC[Si](C)(C)C1=CC([Si](C)(C)C2C=C([Si](C)(C)C)C([Si](C)(C)C)=C2)C=C1[Si](C)(C)C
InChIInChI=1S/C24H48Si5/c1-25(2,3)21-15-19(16-22(21)26(4,5)6)29(13,14)20-17-23(27(7,8)9)24(18-20)28(10,11)12/h15-20H,1-14H3
InChIKeyWYPBMUBBAILNPF-UHFFFAOYSA-N
MW477.08 g/mol
LogP8.68
Rot. Bonds6

About bis[3,4-bis(trimethylsilyl)cyclopenta-2,4-dien-1-yl]-dimethylsilane

bis[3,4-bis(trimethylsilyl)cyclopenta-2,4-dien-1-yl]-dimethylsilane (PubChem CID 12979789) has the molecular formula C24H48Si5 and a molecular weight of 477.08 g/mol. Its IUPAC name is bis[3,4-bis(trimethylsilyl)cyclopenta-2,4-dien-1-yl]-dimethylsilane.

Molecular Properties

Compound Namebis[3,4-bis(trimethylsilyl)cyclopenta-2,4-dien-1-yl]-dimethylsilane
PubChem CID12979789
Molecular FormulaC24H48Si5
Molecular Weight477.08 g/mol
Exact Mass476.26
IUPAC Namebis[3,4-bis(trimethylsilyl)cyclopenta-2,4-dien-1-yl]-dimethylsilane
SMILESC[Si](C)(C)C1=CC([Si](C)(C)C2C=C([Si](C)(C)C)C([Si](C)(C)C)=C2)C=C1[Si](C)(C)C
InChIInChI=1S/C24H48Si5/c1-25(2,3)21-15-19(16-22(21)26(4,5)6)29(13,14)20-17-23(27(7,8)9)24(18-20)28(10,11)12/h15-20H,1-14H3
InChIKeyWYPBMUBBAILNPF-UHFFFAOYSA-N
XLogP8.68
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500477.08
LogP ≤ 58.68
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 bis[3,4-bis(trimethylsilyl)cyclopenta-2,4-dien-1-yl]-dimethylsilane?
The IUPAC name of bis[3,4-bis(trimethylsilyl)cyclopenta-2,4-dien-1-yl]-dimethylsilane (CID 12979789) is bis[3,4-bis(trimethylsilyl)cyclopenta-2,4-dien-1-yl]-dimethylsilane.
What is the SMILES notation for bis[3,4-bis(trimethylsilyl)cyclopenta-2,4-dien-1-yl]-dimethylsilane?
The canonical SMILES for bis[3,4-bis(trimethylsilyl)cyclopenta-2,4-dien-1-yl]-dimethylsilane is C[Si](C)(C)C1=CC([Si](C)(C)C2C=C([Si](C)(C)C)C([Si](C)(C)C)=C2)C=C1[Si](C)(C)C.
What is the InChIKey of bis[3,4-bis(trimethylsilyl)cyclopenta-2,4-dien-1-yl]-dimethylsilane?
The InChIKey is WYPBMUBBAILNPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H48Si5/c1-25(2,3)21-15-19(16-22(21)26(4,5)6)29(13,14)20-17-23(27(7,8)9)24(18-20)28(10,11)12/h15-20H,1-14H3.
What are the key properties of bis[3,4-bis(trimethylsilyl)cyclopenta-2,4-dien-1-yl]-dimethylsilane?
bis[3,4-bis(trimethylsilyl)cyclopenta-2,4-dien-1-yl]-dimethylsilane has a molecular weight of 477.08 g/mol, XLogP of 8.68, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis[3,4-bis(trimethylsilyl)cyclopenta-2,4-dien-1-yl]-dimethylsilane is sourced from PubChem (CID 12979789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).