2-methyl-1-triethylsilylpropan-1-one

C10H22OSi — CID 86209852

IUPAC2-methyl-1-triethylsilylpropan-1-one
SMILESCC[Si](CC)(CC)C(=O)C(C)C
InChIInChI=1S/C10H22OSi/c1-6-12(7-2,8-3)10(11)9(4)5/h9H,6-8H2,1-5H3
InChIKeyFCSMSMWQQOSXIT-UHFFFAOYSA-N
MW186.37 g/mol
LogP3.26
Rot. Bonds5

About 2-methyl-1-triethylsilylpropan-1-one

2-methyl-1-triethylsilylpropan-1-one (PubChem CID 86209852) has the molecular formula C10H22OSi and a molecular weight of 186.37 g/mol. Its IUPAC name is 2-methyl-1-triethylsilylpropan-1-one.

Molecular Properties

Compound Name2-methyl-1-triethylsilylpropan-1-one
PubChem CID86209852
Molecular FormulaC10H22OSi
Molecular Weight186.37 g/mol
Exact Mass186.14
IUPAC Name2-methyl-1-triethylsilylpropan-1-one
SMILESCC[Si](CC)(CC)C(=O)C(C)C
InChIInChI=1S/C10H22OSi/c1-6-12(7-2,8-3)10(11)9(4)5/h9H,6-8H2,1-5H3
InChIKeyFCSMSMWQQOSXIT-UHFFFAOYSA-N
XLogP3.26
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.37
LogP ≤ 53.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Silane, (cyclopropylcarbonyl)(1,1-dimethylethyl)dimethyl-
CID 552806
2-[Tert-butyl(dimethyl)silyl]pentan-3-one
CID 13775509
Acetyl(tert-butyl)dimethylsilane
CID 11367157
1-Tri(propan-2-yl)silylpropan-1-one
CID 3781751
Silane, trimethyl(2-methyl-1-oxopropyl)-
CID 4695109
Silane, (1,1-dimethylethyl)dimethyl(1-oxopentyl)-
CID 11672873
(2R)-2-[tert-butyl(dimethyl)silyl]pentan-3-one
CID 11745677
2,2-Dimethyl-1-(trimethylsilyl)propan-1-one
CID 12829477
1-[Tert-butyl(dimethyl)silyl]propane-1,2-dione
CID 12929552
1-[tert-Butyl(dimethyl)silyl]propan-1-one
CID 13446384
(2S)-2-[tert-butyl(dimethyl)silyl]pentan-3-one
CID 13775510
2,2-Dimethyl-1-[methyl-bis(trimethylsilyl)silyl]propan-1-one
CID 14115329

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-triethylsilylpropan-1-one?
The IUPAC name of 2-methyl-1-triethylsilylpropan-1-one (CID 86209852) is 2-methyl-1-triethylsilylpropan-1-one.
What is the SMILES notation for 2-methyl-1-triethylsilylpropan-1-one?
The canonical SMILES for 2-methyl-1-triethylsilylpropan-1-one is CC[Si](CC)(CC)C(=O)C(C)C.
What is the InChIKey of 2-methyl-1-triethylsilylpropan-1-one?
The InChIKey is FCSMSMWQQOSXIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22OSi/c1-6-12(7-2,8-3)10(11)9(4)5/h9H,6-8H2,1-5H3.
What are the key properties of 2-methyl-1-triethylsilylpropan-1-one?
2-methyl-1-triethylsilylpropan-1-one has a molecular weight of 186.37 g/mol, XLogP of 3.26, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-triethylsilylpropan-1-one is sourced from PubChem (CID 86209852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).