2-tri(propan-2-yl)silylprop-1-en-1-one

C12H24OSi — CID 14451165

IUPAC2-tri(propan-2-yl)silylprop-1-en-1-one
SMILESCC(=C=O)[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C12H24OSi/c1-9(2)14(10(3)4,11(5)6)12(7)8-13/h9-11H,1-7H3
InChIKeyVHECIDBDSKVRGE-UHFFFAOYSA-N
MW212.41 g/mol
LogP3.98
Rot. Bonds4

About 2-tri(propan-2-yl)silylprop-1-en-1-one

2-tri(propan-2-yl)silylprop-1-en-1-one (PubChem CID 14451165) has the molecular formula C12H24OSi and a molecular weight of 212.41 g/mol. Its IUPAC name is 2-tri(propan-2-yl)silylprop-1-en-1-one.

Molecular Properties

Compound Name2-tri(propan-2-yl)silylprop-1-en-1-one
PubChem CID14451165
Molecular FormulaC12H24OSi
Molecular Weight212.41 g/mol
Exact Mass212.16
IUPAC Name2-tri(propan-2-yl)silylprop-1-en-1-one
SMILESCC(=C=O)[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C12H24OSi/c1-9(2)14(10(3)4,11(5)6)12(7)8-13/h9-11H,1-7H3
InChIKeyVHECIDBDSKVRGE-UHFFFAOYSA-N
XLogP3.98
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.41
LogP ≤ 53.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'ketene', 'substructure': 'N/A'}

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Related Compounds

Ethenone, [tris(1-methylethyl)silyl]-
CID 5325347
2-Triethylsilyl-2-trimethylsilylethenone
CID 5325349
Butyl(trimethylsilyl)ketene
CID 10931867
(t-Butyldimethylsilyl)trimethylsilylketene
CID 11075174
2,3-Bis(trimethylsilyl)penta-1,3,4-trien-1-one
CID 15273820
(Triisopropylsilyl)trimethylsilylketene
CID 15496182
Acetyl(tert-butyl)dimethylsilane
CID 11367157
Ethenone, [(1,1-dimethylethyl)dimethylsilyl]-
CID 11768821
Triethylsilyl ketene
CID 12426028
2-Trimethylsilylprop-1-en-1-one
CID 13614843
1-(Triethylsilyl)ethan-1-one
CID 14400427
1-Tri(propan-2-yl)silylpropan-1-one
CID 3781751

Frequently Asked Questions

What is the IUPAC name of 2-tri(propan-2-yl)silylprop-1-en-1-one?
The IUPAC name of 2-tri(propan-2-yl)silylprop-1-en-1-one (CID 14451165) is 2-tri(propan-2-yl)silylprop-1-en-1-one.
What is the SMILES notation for 2-tri(propan-2-yl)silylprop-1-en-1-one?
The canonical SMILES for 2-tri(propan-2-yl)silylprop-1-en-1-one is CC(=C=O)[Si](C(C)C)(C(C)C)C(C)C.
What is the InChIKey of 2-tri(propan-2-yl)silylprop-1-en-1-one?
The InChIKey is VHECIDBDSKVRGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24OSi/c1-9(2)14(10(3)4,11(5)6)12(7)8-13/h9-11H,1-7H3.
What are the key properties of 2-tri(propan-2-yl)silylprop-1-en-1-one?
2-tri(propan-2-yl)silylprop-1-en-1-one has a molecular weight of 212.41 g/mol, XLogP of 3.98, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tri(propan-2-yl)silylprop-1-en-1-one is sourced from PubChem (CID 14451165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).