dimethylsilicon(2+) diacetate

C6H16O4Si — CID 160572514

IUPACdimethylsilicon(2+) diacetate
SMILESCC(=O)[O-].CC(=O)[O-].C[SiH4+2]C
InChIInChI=1S/2C2H4O2.C2H10Si/c2*1-2(3)4;1-3-2/h2*1H3,(H,3,4);1-2H3,3H4/q;;+2/p-2
InChIKeyUEUBRYCYVAPPQM-UHFFFAOYSA-L
MW180.28 g/mol
LogP-2.77
Rot. Bonds

About dimethylsilicon(2+) diacetate

dimethylsilicon(2+) diacetate (PubChem CID 160572514) has the molecular formula C6H16O4Si and a molecular weight of 180.28 g/mol. Its IUPAC name is dimethylsilicon(2+) diacetate.

Molecular Properties

Compound Namedimethylsilicon(2+) diacetate
PubChem CID160572514
Molecular FormulaC6H16O4Si
Molecular Weight180.28 g/mol
Exact Mass180.08
IUPAC Namedimethylsilicon(2+) diacetate
SMILESCC(=O)[O-].CC(=O)[O-].C[SiH4+2]C
InChIInChI=1S/2C2H4O2.C2H10Si/c2*1-2(3)4;1-3-2/h2*1H3,(H,3,4);1-2H3,3H4/q;;+2/p-2
InChIKeyUEUBRYCYVAPPQM-UHFFFAOYSA-L
XLogP-2.77
TPSA80.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.28
LogP ≤ 5-2.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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 dimethylsilicon(2+) diacetate?
The IUPAC name of dimethylsilicon(2+) diacetate (CID 160572514) is dimethylsilicon(2+) diacetate.
What is the SMILES notation for dimethylsilicon(2+) diacetate?
The canonical SMILES for dimethylsilicon(2+) diacetate is CC(=O)[O-].CC(=O)[O-].C[SiH4+2]C.
What is the InChIKey of dimethylsilicon(2+) diacetate?
The InChIKey is UEUBRYCYVAPPQM-UHFFFAOYSA-L. The full InChI is InChI=1S/2C2H4O2.C2H10Si/c2*1-2(3)4;1-3-2/h2*1H3,(H,3,4);1-2H3,3H4/q;;+2/p-2.
What are the key properties of dimethylsilicon(2+) diacetate?
dimethylsilicon(2+) diacetate has a molecular weight of 180.28 g/mol, XLogP of -2.77, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for dimethylsilicon(2+) diacetate is sourced from PubChem (CID 160572514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).