oxiran-2-yl(silyl)methanone

C3H6O2Si — CID 123892930

IUPACoxiran-2-yl(silyl)methanone
SMILESO=C([SiH3])C1CO1
InChIInChI=1S/C3H6O2Si/c4-3(6)2-1-5-2/h2H,1H2,6H3
InChIKeyHCFMUWUGFZEFHH-UHFFFAOYSA-N
MW102.16 g/mol
LogP-1.72
Rot. Bonds1

About oxiran-2-yl(silyl)methanone

oxiran-2-yl(silyl)methanone (PubChem CID 123892930) has the molecular formula C3H6O2Si and a molecular weight of 102.16 g/mol. Its IUPAC name is oxiran-2-yl(silyl)methanone.

Molecular Properties

Compound Nameoxiran-2-yl(silyl)methanone
PubChem CID123892930
Molecular FormulaC3H6O2Si
Molecular Weight102.16 g/mol
Exact Mass102.01
IUPAC Nameoxiran-2-yl(silyl)methanone
SMILESO=C([SiH3])C1CO1
InChIInChI=1S/C3H6O2Si/c4-3(6)2-1-5-2/h2H,1H2,6H3
InChIKeyHCFMUWUGFZEFHH-UHFFFAOYSA-N
XLogP-1.72
TPSA29.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500102.16
LogP ≤ 5-1.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of oxiran-2-yl(silyl)methanone?
The IUPAC name of oxiran-2-yl(silyl)methanone (CID 123892930) is oxiran-2-yl(silyl)methanone.
What is the SMILES notation for oxiran-2-yl(silyl)methanone?
The canonical SMILES for oxiran-2-yl(silyl)methanone is O=C([SiH3])C1CO1.
What is the InChIKey of oxiran-2-yl(silyl)methanone?
The InChIKey is HCFMUWUGFZEFHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6O2Si/c4-3(6)2-1-5-2/h2H,1H2,6H3.
What are the key properties of oxiran-2-yl(silyl)methanone?
oxiran-2-yl(silyl)methanone has a molecular weight of 102.16 g/mol, XLogP of -1.72, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for oxiran-2-yl(silyl)methanone is sourced from PubChem (CID 123892930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).