[Boranetriyltri(ethane-2,1-diyl)]tris(methylsilane)

C9H21BSi3 — CID 78062575

IUPAC—
SMILESC[Si]CCB(CC[Si]C)CC[Si]C
InChIInChI=1S/C9H21BSi3/c1-11-7-4-10(5-8-12-2)6-9-13-3/h4-9H2,1-3H3
InChIKeyOJMZDMGKZFIWMY-UHFFFAOYSA-N
MW224.34 g/mol
LogP2.99
Rot. Bonds9

About [Boranetriyltri(ethane-2,1-diyl)]tris(methylsilane)

[Boranetriyltri(ethane-2,1-diyl)]tris(methylsilane) (PubChem CID 78062575) has the molecular formula C9H21BSi3 and a molecular weight of 224.34 g/mol.

Molecular Properties

Compound Name[Boranetriyltri(ethane-2,1-diyl)]tris(methylsilane)
PubChem CID78062575
Molecular FormulaC9H21BSi3
Molecular Weight224.34 g/mol
Exact Mass224.10
IUPAC Name—
SMILESC[Si]CCB(CC[Si]C)CC[Si]C
InChIInChI=1S/C9H21BSi3/c1-11-7-4-10(5-8-12-2)6-9-13-3/h4-9H2,1-3H3
InChIKeyOJMZDMGKZFIWMY-UHFFFAOYSA-N
XLogP2.99
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.34
LogP ≤ 52.99
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 [Boranetriyltri(ethane-2,1-diyl)]tris(methylsilane)?
The IUPAC name of [Boranetriyltri(ethane-2,1-diyl)]tris(methylsilane) (CID 78062575) is not available.
What is the SMILES notation for [Boranetriyltri(ethane-2,1-diyl)]tris(methylsilane)?
The canonical SMILES for [Boranetriyltri(ethane-2,1-diyl)]tris(methylsilane) is C[Si]CCB(CC[Si]C)CC[Si]C.
What is the InChIKey of [Boranetriyltri(ethane-2,1-diyl)]tris(methylsilane)?
The InChIKey is OJMZDMGKZFIWMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21BSi3/c1-11-7-4-10(5-8-12-2)6-9-13-3/h4-9H2,1-3H3.
What are the key properties of [Boranetriyltri(ethane-2,1-diyl)]tris(methylsilane)?
[Boranetriyltri(ethane-2,1-diyl)]tris(methylsilane) has a molecular weight of 224.34 g/mol, XLogP of 2.99, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [Boranetriyltri(ethane-2,1-diyl)]tris(methylsilane) is sourced from PubChem (CID 78062575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).