1-[dimethyl(2-methylprop-2-enoyl)silyl]-2-methylprop-2-en-1-one

C10H16O2Si — CID 89427583

IUPAC1-[dimethyl(2-methylprop-2-enoyl)silyl]-2-methylprop-2-en-1-one
SMILESC=C(C)C(=O)[Si](C)(C)C(=O)C(=C)C
InChIInChI=1S/C10H16O2Si/c1-7(2)9(11)13(5,6)10(12)8(3)4/h1,3H2,2,4-6H3
InChIKeyFFYOCMPAAUKXPW-UHFFFAOYSA-N
MW196.32 g/mol
LogP2.06
Rot. Bonds4

About 1-[dimethyl(2-methylprop-2-enoyl)silyl]-2-methylprop-2-en-1-one

1-[dimethyl(2-methylprop-2-enoyl)silyl]-2-methylprop-2-en-1-one (PubChem CID 89427583) has the molecular formula C10H16O2Si and a molecular weight of 196.32 g/mol. Its IUPAC name is 1-[dimethyl(2-methylprop-2-enoyl)silyl]-2-methylprop-2-en-1-one.

Molecular Properties

Compound Name1-[dimethyl(2-methylprop-2-enoyl)silyl]-2-methylprop-2-en-1-one
PubChem CID89427583
Molecular FormulaC10H16O2Si
Molecular Weight196.32 g/mol
Exact Mass196.09
IUPAC Name1-[dimethyl(2-methylprop-2-enoyl)silyl]-2-methylprop-2-en-1-one
SMILESC=C(C)C(=O)[Si](C)(C)C(=O)C(=C)C
InChIInChI=1S/C10H16O2Si/c1-7(2)9(11)13(5,6)10(12)8(3)4/h1,3H2,2,4-6H3
InChIKeyFFYOCMPAAUKXPW-UHFFFAOYSA-N
XLogP2.06
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.32
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-[dimethyl(2-methylprop-2-enoyl)silyl]-2-methylprop-2-en-1-one?
The IUPAC name of 1-[dimethyl(2-methylprop-2-enoyl)silyl]-2-methylprop-2-en-1-one (CID 89427583) is 1-[dimethyl(2-methylprop-2-enoyl)silyl]-2-methylprop-2-en-1-one.
What is the SMILES notation for 1-[dimethyl(2-methylprop-2-enoyl)silyl]-2-methylprop-2-en-1-one?
The canonical SMILES for 1-[dimethyl(2-methylprop-2-enoyl)silyl]-2-methylprop-2-en-1-one is C=C(C)C(=O)[Si](C)(C)C(=O)C(=C)C.
What is the InChIKey of 1-[dimethyl(2-methylprop-2-enoyl)silyl]-2-methylprop-2-en-1-one?
The InChIKey is FFYOCMPAAUKXPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O2Si/c1-7(2)9(11)13(5,6)10(12)8(3)4/h1,3H2,2,4-6H3.
What are the key properties of 1-[dimethyl(2-methylprop-2-enoyl)silyl]-2-methylprop-2-en-1-one?
1-[dimethyl(2-methylprop-2-enoyl)silyl]-2-methylprop-2-en-1-one has a molecular weight of 196.32 g/mol, XLogP of 2.06, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[dimethyl(2-methylprop-2-enoyl)silyl]-2-methylprop-2-en-1-one is sourced from PubChem (CID 89427583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).