1,1-bis(trimethylsilyl)but-3-enyl-trimethylsilane

C13H32Si3 — CID 12727914

IUPAC1,1-bis(trimethylsilyl)but-3-enyl-trimethylsilane
SMILESC=CCC([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C13H32Si3/c1-11-12-13(14(2,3)4,15(5,6)7)16(8,9)10/h11H,1,12H2,2-10H3
InChIKeyIOJISFJHQPCZOJ-UHFFFAOYSA-N
MW272.66 g/mol
LogP5.40
Rot. Bonds5

About 1,1-bis(trimethylsilyl)but-3-enyl-trimethylsilane

1,1-bis(trimethylsilyl)but-3-enyl-trimethylsilane (PubChem CID 12727914) has the molecular formula C13H32Si3 and a molecular weight of 272.66 g/mol. Its IUPAC name is 1,1-bis(trimethylsilyl)but-3-enyl-trimethylsilane.

Molecular Properties

Compound Name1,1-bis(trimethylsilyl)but-3-enyl-trimethylsilane
PubChem CID12727914
Molecular FormulaC13H32Si3
Molecular Weight272.66 g/mol
Exact Mass272.18
IUPAC Name1,1-bis(trimethylsilyl)but-3-enyl-trimethylsilane
SMILESC=CCC([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C13H32Si3/c1-11-12-13(14(2,3)4,15(5,6)7)16(8,9)10/h11H,1,12H2,2-10H3
InChIKeyIOJISFJHQPCZOJ-UHFFFAOYSA-N
XLogP5.40
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500272.66
LogP ≤ 55.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 1,1-bis(trimethylsilyl)but-3-enyl-trimethylsilane?
The IUPAC name of 1,1-bis(trimethylsilyl)but-3-enyl-trimethylsilane (CID 12727914) is 1,1-bis(trimethylsilyl)but-3-enyl-trimethylsilane.
What is the SMILES notation for 1,1-bis(trimethylsilyl)but-3-enyl-trimethylsilane?
The canonical SMILES for 1,1-bis(trimethylsilyl)but-3-enyl-trimethylsilane is C=CCC([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C.
What is the InChIKey of 1,1-bis(trimethylsilyl)but-3-enyl-trimethylsilane?
The InChIKey is IOJISFJHQPCZOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H32Si3/c1-11-12-13(14(2,3)4,15(5,6)7)16(8,9)10/h11H,1,12H2,2-10H3.
What are the key properties of 1,1-bis(trimethylsilyl)but-3-enyl-trimethylsilane?
1,1-bis(trimethylsilyl)but-3-enyl-trimethylsilane has a molecular weight of 272.66 g/mol, XLogP of 5.40, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-bis(trimethylsilyl)but-3-enyl-trimethylsilane is sourced from PubChem (CID 12727914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).