1-tri(propan-2-yl)silylethanone

C11H24OSi — CID 10888936

IUPAC1-tri(propan-2-yl)silylethanone
SMILESCC(=O)[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C11H24OSi/c1-8(2)13(9(3)4,10(5)6)11(7)12/h8-10H,1-7H3
InChIKeyHYJSILVJOHEFLY-UHFFFAOYSA-N
MW200.40 g/mol
LogP3.79
Rot. Bonds4

About 1-tri(propan-2-yl)silylethanone

1-tri(propan-2-yl)silylethanone (PubChem CID 10888936) has the molecular formula C11H24OSi and a molecular weight of 200.40 g/mol. Its IUPAC name is 1-tri(propan-2-yl)silylethanone.

Molecular Properties

Compound Name1-tri(propan-2-yl)silylethanone
PubChem CID10888936
Molecular FormulaC11H24OSi
Molecular Weight200.40 g/mol
Exact Mass200.16
IUPAC Name1-tri(propan-2-yl)silylethanone
SMILESCC(=O)[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C11H24OSi/c1-8(2)13(9(3)4,10(5)6)11(7)12/h8-10H,1-7H3
InChIKeyHYJSILVJOHEFLY-UHFFFAOYSA-N
XLogP3.79
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.40
LogP ≤ 53.79
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 1-tri(propan-2-yl)silylethanone?
The IUPAC name of 1-tri(propan-2-yl)silylethanone (CID 10888936) is 1-tri(propan-2-yl)silylethanone.
What is the SMILES notation for 1-tri(propan-2-yl)silylethanone?
The canonical SMILES for 1-tri(propan-2-yl)silylethanone is CC(=O)[Si](C(C)C)(C(C)C)C(C)C.
What is the InChIKey of 1-tri(propan-2-yl)silylethanone?
The InChIKey is HYJSILVJOHEFLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24OSi/c1-8(2)13(9(3)4,10(5)6)11(7)12/h8-10H,1-7H3.
What are the key properties of 1-tri(propan-2-yl)silylethanone?
1-tri(propan-2-yl)silylethanone has a molecular weight of 200.40 g/mol, XLogP of 3.79, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-tri(propan-2-yl)silylethanone is sourced from PubChem (CID 10888936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).