2,2-dimethyl-1-tris(trimethylsilyl)silylpropan-1-one

C14H36OSi4 — CID 553601

IUPAC2,2-dimethyl-1-tris(trimethylsilyl)silylpropan-1-one
SMILESCC(C)(C)C(=O)[Si]([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C14H36OSi4/c1-14(2,3)13(15)19(16(4,5)6,17(7,8)9)18(10,11)12/h1-12H3
InChIKeyKUYILKYNBKPRDV-UHFFFAOYSA-N
MW332.79 g/mol
LogP4.84
Rot. Bonds4

About 2,2-dimethyl-1-tris(trimethylsilyl)silylpropan-1-one

2,2-dimethyl-1-tris(trimethylsilyl)silylpropan-1-one (PubChem CID 553601) has the molecular formula C14H36OSi4 and a molecular weight of 332.79 g/mol. Its IUPAC name is 2,2-dimethyl-1-tris(trimethylsilyl)silylpropan-1-one.

Molecular Properties

Compound Name2,2-dimethyl-1-tris(trimethylsilyl)silylpropan-1-one
PubChem CID553601
Molecular FormulaC14H36OSi4
Molecular Weight332.79 g/mol
Exact Mass332.18
IUPAC Name2,2-dimethyl-1-tris(trimethylsilyl)silylpropan-1-one
SMILESCC(C)(C)C(=O)[Si]([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C14H36OSi4/c1-14(2,3)13(15)19(16(4,5)6,17(7,8)9)18(10,11)12/h1-12H3
InChIKeyKUYILKYNBKPRDV-UHFFFAOYSA-N
XLogP4.84
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.79
LogP ≤ 54.84
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 2,2-dimethyl-1-tris(trimethylsilyl)silylpropan-1-one?
The IUPAC name of 2,2-dimethyl-1-tris(trimethylsilyl)silylpropan-1-one (CID 553601) is 2,2-dimethyl-1-tris(trimethylsilyl)silylpropan-1-one.
What is the SMILES notation for 2,2-dimethyl-1-tris(trimethylsilyl)silylpropan-1-one?
The canonical SMILES for 2,2-dimethyl-1-tris(trimethylsilyl)silylpropan-1-one is CC(C)(C)C(=O)[Si]([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C.
What is the InChIKey of 2,2-dimethyl-1-tris(trimethylsilyl)silylpropan-1-one?
The InChIKey is KUYILKYNBKPRDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H36OSi4/c1-14(2,3)13(15)19(16(4,5)6,17(7,8)9)18(10,11)12/h1-12H3.
What are the key properties of 2,2-dimethyl-1-tris(trimethylsilyl)silylpropan-1-one?
2,2-dimethyl-1-tris(trimethylsilyl)silylpropan-1-one has a molecular weight of 332.79 g/mol, XLogP of 4.84, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-1-tris(trimethylsilyl)silylpropan-1-one is sourced from PubChem (CID 553601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).