3-silylsulfonyloxyprop-1-ene

C3H8O3SSi — CID 173032447

IUPAC3-silylsulfonyloxyprop-1-ene
SMILESC=CCOS(=O)(=O)[SiH3]
InChIInChI=1S/C3H8O3SSi/c1-2-3-6-7(4,5)8/h2H,1,3H2,8H3
InChIKeyHWUORPCDWLGRTI-UHFFFAOYSA-N
MW152.25 g/mol
LogP-1.20
Rot. Bonds3

About 3-silylsulfonyloxyprop-1-ene

3-silylsulfonyloxyprop-1-ene (PubChem CID 173032447) has the molecular formula C3H8O3SSi and a molecular weight of 152.25 g/mol. Its IUPAC name is 3-silylsulfonyloxyprop-1-ene.

Molecular Properties

Compound Name3-silylsulfonyloxyprop-1-ene
PubChem CID173032447
Molecular FormulaC3H8O3SSi
Molecular Weight152.25 g/mol
Exact Mass152.00
IUPAC Name3-silylsulfonyloxyprop-1-ene
SMILESC=CCOS(=O)(=O)[SiH3]
InChIInChI=1S/C3H8O3SSi/c1-2-3-6-7(4,5)8/h2H,1,3H2,8H3
InChIKeyHWUORPCDWLGRTI-UHFFFAOYSA-N
XLogP-1.20
TPSA43.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.25
LogP ≤ 5-1.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-silylsulfonyloxyprop-1-ene?
The IUPAC name of 3-silylsulfonyloxyprop-1-ene (CID 173032447) is 3-silylsulfonyloxyprop-1-ene.
What is the SMILES notation for 3-silylsulfonyloxyprop-1-ene?
The canonical SMILES for 3-silylsulfonyloxyprop-1-ene is C=CCOS(=O)(=O)[SiH3].
What is the InChIKey of 3-silylsulfonyloxyprop-1-ene?
The InChIKey is HWUORPCDWLGRTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8O3SSi/c1-2-3-6-7(4,5)8/h2H,1,3H2,8H3.
What are the key properties of 3-silylsulfonyloxyprop-1-ene?
3-silylsulfonyloxyprop-1-ene has a molecular weight of 152.25 g/mol, XLogP of -1.20, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-silylsulfonyloxyprop-1-ene is sourced from PubChem (CID 173032447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).