1-(1-trimethylsilylcyclopropyl)propan-1-one

C9H18OSi — CID 10797257

IUPAC1-(1-trimethylsilylcyclopropyl)propan-1-one
SMILESCCC(=O)C1([Si](C)(C)C)CC1
InChIInChI=1S/C9H18OSi/c1-5-8(10)9(6-7-9)11(2,3)4/h5-7H2,1-4H3
InChIKeyJVNHEVKHQOFKFS-UHFFFAOYSA-N
MW170.33 g/mol
LogP2.84
Rot. Bonds3

About 1-(1-trimethylsilylcyclopropyl)propan-1-one

1-(1-trimethylsilylcyclopropyl)propan-1-one (PubChem CID 10797257) has the molecular formula C9H18OSi and a molecular weight of 170.33 g/mol. Its IUPAC name is 1-(1-trimethylsilylcyclopropyl)propan-1-one.

Molecular Properties

Compound Name1-(1-trimethylsilylcyclopropyl)propan-1-one
PubChem CID10797257
Molecular FormulaC9H18OSi
Molecular Weight170.33 g/mol
Exact Mass170.11
IUPAC Name1-(1-trimethylsilylcyclopropyl)propan-1-one
SMILESCCC(=O)C1([Si](C)(C)C)CC1
InChIInChI=1S/C9H18OSi/c1-5-8(10)9(6-7-9)11(2,3)4/h5-7H2,1-4H3
InChIKeyJVNHEVKHQOFKFS-UHFFFAOYSA-N
XLogP2.84
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.33
LogP ≤ 52.84
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

2-[Tert-butyl(dimethyl)silyl]hexan-3-one
CID 15033613
1-Cyclopropyl-2-trimethylsilylethanone
CID 91510198
5-Methyl-3-(trimethylsilylmethyl)hexan-2-one
CID 12607716
4-Methyl-4-trimethylsilylpentan-2-one
CID 12736439
5-Methyl-1-trimethylsilylhexan-3-one
CID 14112751
4-[Tert-butyl(dimethyl)silyl]hexan-3-one
CID 15033614
5,5-Dimethyl-1-trimethylsilylhexan-3-one
CID 100921794
(2S,4S)-2-[dimethyl(2-methylpentan-2-yl)silyl]-4-iodohexan-3-one
CID 134883463
(2S)-2-[dimethyl(2-methylpentan-2-yl)silyl]hexan-3-one
CID 134897153
(2S,4R)-2-[tert-butyl(dimethyl)silyl]-4-fluoro-5-methylhexan-3-one
CID 15522419
4,4-Dimethyl-1-trimethylsilylpentan-2-one
CID 14272124
2,4-Dimethyl-1-trimethylsilylhexan-3-one
CID 14902795

Frequently Asked Questions

What is the IUPAC name of 1-(1-trimethylsilylcyclopropyl)propan-1-one?
The IUPAC name of 1-(1-trimethylsilylcyclopropyl)propan-1-one (CID 10797257) is 1-(1-trimethylsilylcyclopropyl)propan-1-one.
What is the SMILES notation for 1-(1-trimethylsilylcyclopropyl)propan-1-one?
The canonical SMILES for 1-(1-trimethylsilylcyclopropyl)propan-1-one is CCC(=O)C1([Si](C)(C)C)CC1.
What is the InChIKey of 1-(1-trimethylsilylcyclopropyl)propan-1-one?
The InChIKey is JVNHEVKHQOFKFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18OSi/c1-5-8(10)9(6-7-9)11(2,3)4/h5-7H2,1-4H3.
What are the key properties of 1-(1-trimethylsilylcyclopropyl)propan-1-one?
1-(1-trimethylsilylcyclopropyl)propan-1-one has a molecular weight of 170.33 g/mol, XLogP of 2.84, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-trimethylsilylcyclopropyl)propan-1-one is sourced from PubChem (CID 10797257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).