3-phenyl-1-triphenylsilylpropan-1-one

C27H24OSi — CID 11984035

IUPAC3-phenyl-1-triphenylsilylpropan-1-one
SMILESO=C(CCc1ccccc1)[Si](c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C27H24OSi/c28-27(22-21-23-13-5-1-6-14-23)29(24-15-7-2-8-16-24,25-17-9-3-10-18-25)26-19-11-4-12-20-26/h1-20H,21-22H2
InChIKeyBXLMSAOFXCSVPF-UHFFFAOYSA-N
MW392.57 g/mol
LogP3.90
Rot. Bonds7

About 3-phenyl-1-triphenylsilylpropan-1-one

3-phenyl-1-triphenylsilylpropan-1-one (PubChem CID 11984035) has the molecular formula C27H24OSi and a molecular weight of 392.57 g/mol. Its IUPAC name is 3-phenyl-1-triphenylsilylpropan-1-one.

Molecular Properties

Compound Name3-phenyl-1-triphenylsilylpropan-1-one
PubChem CID11984035
Molecular FormulaC27H24OSi
Molecular Weight392.57 g/mol
Exact Mass392.16
IUPAC Name3-phenyl-1-triphenylsilylpropan-1-one
SMILESO=C(CCc1ccccc1)[Si](c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C27H24OSi/c28-27(22-21-23-13-5-1-6-14-23)29(24-15-7-2-8-16-24,25-17-9-3-10-18-25)26-19-11-4-12-20-26/h1-20H,21-22H2
InChIKeyBXLMSAOFXCSVPF-UHFFFAOYSA-N
XLogP3.90
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.57
LogP ≤ 53.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-phenyl-1-triphenylsilylpropan-1-one?
The IUPAC name of 3-phenyl-1-triphenylsilylpropan-1-one (CID 11984035) is 3-phenyl-1-triphenylsilylpropan-1-one.
What is the SMILES notation for 3-phenyl-1-triphenylsilylpropan-1-one?
The canonical SMILES for 3-phenyl-1-triphenylsilylpropan-1-one is O=C(CCc1ccccc1)[Si](c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of 3-phenyl-1-triphenylsilylpropan-1-one?
The InChIKey is BXLMSAOFXCSVPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H24OSi/c28-27(22-21-23-13-5-1-6-14-23)29(24-15-7-2-8-16-24,25-17-9-3-10-18-25)26-19-11-4-12-20-26/h1-20H,21-22H2.
What are the key properties of 3-phenyl-1-triphenylsilylpropan-1-one?
3-phenyl-1-triphenylsilylpropan-1-one has a molecular weight of 392.57 g/mol, XLogP of 3.90, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-1-triphenylsilylpropan-1-one is sourced from PubChem (CID 11984035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).