sec.-butoxysilane

C4H9OSi — CID 22600299

IUPAC—
SMILESCCC(C)O[Si]
InChIInChI=1S/C4H9OSi/c1-3-4(2)5-6/h4H,3H2,1-2H3
InChIKeyUUFQRPZNNRRXBP-UHFFFAOYSA-N
MW101.20 g/mol
LogP0.88
Rot. Bonds2

About sec.-butoxysilane

sec.-butoxysilane (PubChem CID 22600299) has the molecular formula C4H9OSi and a molecular weight of 101.20 g/mol.

Molecular Properties

Compound Namesec.-butoxysilane
PubChem CID22600299
Molecular FormulaC4H9OSi
Molecular Weight101.20 g/mol
Exact Mass101.04
IUPAC Name—
SMILESCCC(C)O[Si]
InChIInChI=1S/C4H9OSi/c1-3-4(2)5-6/h4H,3H2,1-2H3
InChIKeyUUFQRPZNNRRXBP-UHFFFAOYSA-N
XLogP0.88
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.20
LogP ≤ 50.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 sec.-butoxysilane?
The IUPAC name of sec.-butoxysilane (CID 22600299) is not available.
What is the SMILES notation for sec.-butoxysilane?
The canonical SMILES for sec.-butoxysilane is CCC(C)O[Si].
What is the InChIKey of sec.-butoxysilane?
The InChIKey is UUFQRPZNNRRXBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9OSi/c1-3-4(2)5-6/h4H,3H2,1-2H3.
What are the key properties of sec.-butoxysilane?
sec.-butoxysilane has a molecular weight of 101.20 g/mol, XLogP of 0.88, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for sec.-butoxysilane is sourced from PubChem (CID 22600299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).