2-[(Z)-but-2-enyl]-2-ethenoxy-4,4,5,5-tetramethyl-1,3,2-dioxasilolane

C12H22O3Si — CID 101199759

IUPAC2-[(Z)-but-2-enyl]-2-ethenoxy-4,4,5,5-tetramethyl-1,3,2-dioxasilolane
SMILESC=CO[Si]1(C/C=C\C)OC(C)(C)C(C)(C)O1
InChIInChI=1S/C12H22O3Si/c1-7-9-10-16(13-8-2)14-11(3,4)12(5,6)15-16/h7-9H,2,10H2,1,3-6H3/b9-7-
InChIKeyJWMRUFCUSQRDEZ-CLFYSBASSA-N
MW242.39 g/mol
LogP3.27
Rot. Bonds4

About 2-[(Z)-but-2-enyl]-2-ethenoxy-4,4,5,5-tetramethyl-1,3,2-dioxasilolane

2-[(Z)-but-2-enyl]-2-ethenoxy-4,4,5,5-tetramethyl-1,3,2-dioxasilolane (PubChem CID 101199759) has the molecular formula C12H22O3Si and a molecular weight of 242.39 g/mol. Its IUPAC name is 2-[(Z)-but-2-enyl]-2-ethenoxy-4,4,5,5-tetramethyl-1,3,2-dioxasilolane.

Molecular Properties

Compound Name2-[(Z)-but-2-enyl]-2-ethenoxy-4,4,5,5-tetramethyl-1,3,2-dioxasilolane
PubChem CID101199759
Molecular FormulaC12H22O3Si
Molecular Weight242.39 g/mol
Exact Mass242.13
IUPAC Name2-[(Z)-but-2-enyl]-2-ethenoxy-4,4,5,5-tetramethyl-1,3,2-dioxasilolane
SMILESC=CO[Si]1(C/C=C\C)OC(C)(C)C(C)(C)O1
InChIInChI=1S/C12H22O3Si/c1-7-9-10-16(13-8-2)14-11(3,4)12(5,6)15-16/h7-9H,2,10H2,1,3-6H3/b9-7-
InChIKeyJWMRUFCUSQRDEZ-CLFYSBASSA-N
XLogP3.27
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.39
LogP ≤ 53.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'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 2-[(Z)-but-2-enyl]-2-ethenoxy-4,4,5,5-tetramethyl-1,3,2-dioxasilolane?
The IUPAC name of 2-[(Z)-but-2-enyl]-2-ethenoxy-4,4,5,5-tetramethyl-1,3,2-dioxasilolane (CID 101199759) is 2-[(Z)-but-2-enyl]-2-ethenoxy-4,4,5,5-tetramethyl-1,3,2-dioxasilolane.
What is the SMILES notation for 2-[(Z)-but-2-enyl]-2-ethenoxy-4,4,5,5-tetramethyl-1,3,2-dioxasilolane?
The canonical SMILES for 2-[(Z)-but-2-enyl]-2-ethenoxy-4,4,5,5-tetramethyl-1,3,2-dioxasilolane is C=CO[Si]1(C/C=C\C)OC(C)(C)C(C)(C)O1.
What is the InChIKey of 2-[(Z)-but-2-enyl]-2-ethenoxy-4,4,5,5-tetramethyl-1,3,2-dioxasilolane?
The InChIKey is JWMRUFCUSQRDEZ-CLFYSBASSA-N. The full InChI is InChI=1S/C12H22O3Si/c1-7-9-10-16(13-8-2)14-11(3,4)12(5,6)15-16/h7-9H,2,10H2,1,3-6H3/b9-7-.
What are the key properties of 2-[(Z)-but-2-enyl]-2-ethenoxy-4,4,5,5-tetramethyl-1,3,2-dioxasilolane?
2-[(Z)-but-2-enyl]-2-ethenoxy-4,4,5,5-tetramethyl-1,3,2-dioxasilolane has a molecular weight of 242.39 g/mol, XLogP of 3.27, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(Z)-but-2-enyl]-2-ethenoxy-4,4,5,5-tetramethyl-1,3,2-dioxasilolane is sourced from PubChem (CID 101199759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).