butan-2-ylpentasilolane

C4H18Si5 — CID 175308763

IUPACbutan-2-ylpentasilolane
SMILESCCC(C)[SiH]1[SiH2][SiH2][SiH2][SiH2]1
InChIInChI=1S/C4H18Si5/c1-3-4(2)9-7-5-6-8-9/h4,9H,3,5-8H2,1-2H3
InChIKeyXWBZMYWZWAGEFM-UHFFFAOYSA-N
MW206.62 g/mol
LogP-2.56
Rot. Bonds2

About butan-2-ylpentasilolane

butan-2-ylpentasilolane (PubChem CID 175308763) has the molecular formula C4H18Si5 and a molecular weight of 206.62 g/mol. Its IUPAC name is butan-2-ylpentasilolane.

Molecular Properties

Compound Namebutan-2-ylpentasilolane
PubChem CID175308763
Molecular FormulaC4H18Si5
Molecular Weight206.62 g/mol
Exact Mass206.03
IUPAC Namebutan-2-ylpentasilolane
SMILESCCC(C)[SiH]1[SiH2][SiH2][SiH2][SiH2]1
InChIInChI=1S/C4H18Si5/c1-3-4(2)9-7-5-6-8-9/h4,9H,3,5-8H2,1-2H3
InChIKeyXWBZMYWZWAGEFM-UHFFFAOYSA-N
XLogP-2.56
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.62
LogP ≤ 5-2.56
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 butan-2-ylpentasilolane?
The IUPAC name of butan-2-ylpentasilolane (CID 175308763) is butan-2-ylpentasilolane.
What is the SMILES notation for butan-2-ylpentasilolane?
The canonical SMILES for butan-2-ylpentasilolane is CCC(C)[SiH]1[SiH2][SiH2][SiH2][SiH2]1.
What is the InChIKey of butan-2-ylpentasilolane?
The InChIKey is XWBZMYWZWAGEFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H18Si5/c1-3-4(2)9-7-5-6-8-9/h4,9H,3,5-8H2,1-2H3.
What are the key properties of butan-2-ylpentasilolane?
butan-2-ylpentasilolane has a molecular weight of 206.62 g/mol, XLogP of -2.56, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for butan-2-ylpentasilolane is sourced from PubChem (CID 175308763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).