1-(2-trimethylsilylcyclopropen-1-yl)propan-2-ol

C9H18OSi — CID 552554

IUPAC1-(2-trimethylsilylcyclopropen-1-yl)propan-2-ol
SMILESCC(O)CC1=C([Si](C)(C)C)C1
InChIInChI=1S/C9H18OSi/c1-7(10)5-8-6-9(8)11(2,3)4/h7,10H,5-6H2,1-4H3
InChIKeyZEDALIFSFWLNHN-UHFFFAOYSA-N
MW170.33 g/mol
LogP2.34
Rot. Bonds3

About 1-(2-trimethylsilylcyclopropen-1-yl)propan-2-ol

1-(2-trimethylsilylcyclopropen-1-yl)propan-2-ol (PubChem CID 552554) has the molecular formula C9H18OSi and a molecular weight of 170.33 g/mol. Its IUPAC name is 1-(2-trimethylsilylcyclopropen-1-yl)propan-2-ol.

Molecular Properties

Compound Name1-(2-trimethylsilylcyclopropen-1-yl)propan-2-ol
PubChem CID552554
Molecular FormulaC9H18OSi
Molecular Weight170.33 g/mol
Exact Mass170.11
IUPAC Name1-(2-trimethylsilylcyclopropen-1-yl)propan-2-ol
SMILESCC(O)CC1=C([Si](C)(C)C)C1
InChIInChI=1S/C9H18OSi/c1-7(10)5-8-6-9(8)11(2,3)4/h7,10H,5-6H2,1-4H3
InChIKeyZEDALIFSFWLNHN-UHFFFAOYSA-N
XLogP2.34
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.33
LogP ≤ 52.34
H-Bond Donors ≤ 51
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-(2-trimethylsilylcyclopropen-1-yl)propan-2-ol?
The IUPAC name of 1-(2-trimethylsilylcyclopropen-1-yl)propan-2-ol (CID 552554) is 1-(2-trimethylsilylcyclopropen-1-yl)propan-2-ol.
What is the SMILES notation for 1-(2-trimethylsilylcyclopropen-1-yl)propan-2-ol?
The canonical SMILES for 1-(2-trimethylsilylcyclopropen-1-yl)propan-2-ol is CC(O)CC1=C([Si](C)(C)C)C1.
What is the InChIKey of 1-(2-trimethylsilylcyclopropen-1-yl)propan-2-ol?
The InChIKey is ZEDALIFSFWLNHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18OSi/c1-7(10)5-8-6-9(8)11(2,3)4/h7,10H,5-6H2,1-4H3.
What are the key properties of 1-(2-trimethylsilylcyclopropen-1-yl)propan-2-ol?
1-(2-trimethylsilylcyclopropen-1-yl)propan-2-ol has a molecular weight of 170.33 g/mol, XLogP of 2.34, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-trimethylsilylcyclopropen-1-yl)propan-2-ol is sourced from PubChem (CID 552554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).