1-[dimethyl(phenyl)silyl]propan-1-one

C11H16OSi — CID 14976926

IUPAC1-[dimethyl(phenyl)silyl]propan-1-one
SMILESCCC(=O)[Si](C)(C)c1ccccc1
InChIInChI=1S/C11H16OSi/c1-4-11(12)13(2,3)10-8-6-5-7-9-10/h5-9H,4H2,1-3H3
InChIKeyHROBBQKVBVKESN-UHFFFAOYSA-N
MW192.33 g/mol
LogP2.12
Rot. Bonds3

About 1-[dimethyl(phenyl)silyl]propan-1-one

1-[dimethyl(phenyl)silyl]propan-1-one (PubChem CID 14976926) has the molecular formula C11H16OSi and a molecular weight of 192.33 g/mol. Its IUPAC name is 1-[dimethyl(phenyl)silyl]propan-1-one.

Molecular Properties

Compound Name1-[dimethyl(phenyl)silyl]propan-1-one
PubChem CID14976926
Molecular FormulaC11H16OSi
Molecular Weight192.33 g/mol
Exact Mass192.10
IUPAC Name1-[dimethyl(phenyl)silyl]propan-1-one
SMILESCCC(=O)[Si](C)(C)c1ccccc1
InChIInChI=1S/C11H16OSi/c1-4-11(12)13(2,3)10-8-6-5-7-9-10/h5-9H,4H2,1-3H3
InChIKeyHROBBQKVBVKESN-UHFFFAOYSA-N
XLogP2.12
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.33
LogP ≤ 52.12
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 1-[dimethyl(phenyl)silyl]propan-1-one?
The IUPAC name of 1-[dimethyl(phenyl)silyl]propan-1-one (CID 14976926) is 1-[dimethyl(phenyl)silyl]propan-1-one.
What is the SMILES notation for 1-[dimethyl(phenyl)silyl]propan-1-one?
The canonical SMILES for 1-[dimethyl(phenyl)silyl]propan-1-one is CCC(=O)[Si](C)(C)c1ccccc1.
What is the InChIKey of 1-[dimethyl(phenyl)silyl]propan-1-one?
The InChIKey is HROBBQKVBVKESN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16OSi/c1-4-11(12)13(2,3)10-8-6-5-7-9-10/h5-9H,4H2,1-3H3.
What are the key properties of 1-[dimethyl(phenyl)silyl]propan-1-one?
1-[dimethyl(phenyl)silyl]propan-1-one has a molecular weight of 192.33 g/mol, XLogP of 2.12, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[dimethyl(phenyl)silyl]propan-1-one is sourced from PubChem (CID 14976926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).