1-[dimethyl(trimethylsilyloxy)silyl]-3,3-dimethylpentan-2-one

C12H28O2Si2 — CID 58805551

IUPAC1-[dimethyl(trimethylsilyloxy)silyl]-3,3-dimethylpentan-2-one
SMILESCCC(C)(C)C(=O)C[Si](C)(C)O[Si](C)(C)C
InChIInChI=1S/C12H28O2Si2/c1-9-12(2,3)11(13)10-16(7,8)14-15(4,5)6/h9-10H2,1-8H3
InChIKeySMNMMGYRGVTNEN-UHFFFAOYSA-N
MW260.53 g/mol
LogP4.05
Rot. Bonds6

About 1-[dimethyl(trimethylsilyloxy)silyl]-3,3-dimethylpentan-2-one

1-[dimethyl(trimethylsilyloxy)silyl]-3,3-dimethylpentan-2-one (PubChem CID 58805551) has the molecular formula C12H28O2Si2 and a molecular weight of 260.53 g/mol. Its IUPAC name is 1-[dimethyl(trimethylsilyloxy)silyl]-3,3-dimethylpentan-2-one.

Molecular Properties

Compound Name1-[dimethyl(trimethylsilyloxy)silyl]-3,3-dimethylpentan-2-one
PubChem CID58805551
Molecular FormulaC12H28O2Si2
Molecular Weight260.53 g/mol
Exact Mass260.16
IUPAC Name1-[dimethyl(trimethylsilyloxy)silyl]-3,3-dimethylpentan-2-one
SMILESCCC(C)(C)C(=O)C[Si](C)(C)O[Si](C)(C)C
InChIInChI=1S/C12H28O2Si2/c1-9-12(2,3)11(13)10-16(7,8)14-15(4,5)6/h9-10H2,1-8H3
InChIKeySMNMMGYRGVTNEN-UHFFFAOYSA-N
XLogP4.05
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.53
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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-[dimethyl(trimethylsilyloxy)silyl]-3,3-dimethylpentan-2-one?
The IUPAC name of 1-[dimethyl(trimethylsilyloxy)silyl]-3,3-dimethylpentan-2-one (CID 58805551) is 1-[dimethyl(trimethylsilyloxy)silyl]-3,3-dimethylpentan-2-one.
What is the SMILES notation for 1-[dimethyl(trimethylsilyloxy)silyl]-3,3-dimethylpentan-2-one?
The canonical SMILES for 1-[dimethyl(trimethylsilyloxy)silyl]-3,3-dimethylpentan-2-one is CCC(C)(C)C(=O)C[Si](C)(C)O[Si](C)(C)C.
What is the InChIKey of 1-[dimethyl(trimethylsilyloxy)silyl]-3,3-dimethylpentan-2-one?
The InChIKey is SMNMMGYRGVTNEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H28O2Si2/c1-9-12(2,3)11(13)10-16(7,8)14-15(4,5)6/h9-10H2,1-8H3.
What are the key properties of 1-[dimethyl(trimethylsilyloxy)silyl]-3,3-dimethylpentan-2-one?
1-[dimethyl(trimethylsilyloxy)silyl]-3,3-dimethylpentan-2-one has a molecular weight of 260.53 g/mol, XLogP of 4.05, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[dimethyl(trimethylsilyloxy)silyl]-3,3-dimethylpentan-2-one is sourced from PubChem (CID 58805551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).