3-methylbut-2-enoxy(tripropyl)silane

C14H30OSi — CID 531303

IUPAC3-methylbut-2-enoxy(tripropyl)silane
SMILESCCC[Si](CCC)(CCC)OCC=C(C)C
InChIInChI=1S/C14H30OSi/c1-6-11-16(12-7-2,13-8-3)15-10-9-14(4)5/h9H,6-8,10-13H2,1-5H3
InChIKeyDBFUQLWMIFQAHQ-UHFFFAOYSA-N
MW242.48 g/mol
LogP5.14
Rot. Bonds9

About 3-methylbut-2-enoxy(tripropyl)silane

3-methylbut-2-enoxy(tripropyl)silane (PubChem CID 531303) has the molecular formula C14H30OSi and a molecular weight of 242.48 g/mol. Its IUPAC name is 3-methylbut-2-enoxy(tripropyl)silane.

Molecular Properties

Compound Name3-methylbut-2-enoxy(tripropyl)silane
PubChem CID531303
Molecular FormulaC14H30OSi
Molecular Weight242.48 g/mol
Exact Mass242.21
IUPAC Name3-methylbut-2-enoxy(tripropyl)silane
SMILESCCC[Si](CCC)(CCC)OCC=C(C)C
InChIInChI=1S/C14H30OSi/c1-6-11-16(12-7-2,13-8-3)15-10-9-14(4)5/h9H,6-8,10-13H2,1-5H3
InChIKeyDBFUQLWMIFQAHQ-UHFFFAOYSA-N
XLogP5.14
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms16
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500242.48
LogP ≤ 55.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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-methylbut-2-enoxy(tripropyl)silane?
The IUPAC name of 3-methylbut-2-enoxy(tripropyl)silane (CID 531303) is 3-methylbut-2-enoxy(tripropyl)silane.
What is the SMILES notation for 3-methylbut-2-enoxy(tripropyl)silane?
The canonical SMILES for 3-methylbut-2-enoxy(tripropyl)silane is CCC[Si](CCC)(CCC)OCC=C(C)C.
What is the InChIKey of 3-methylbut-2-enoxy(tripropyl)silane?
The InChIKey is DBFUQLWMIFQAHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30OSi/c1-6-11-16(12-7-2,13-8-3)15-10-9-14(4)5/h9H,6-8,10-13H2,1-5H3.
What are the key properties of 3-methylbut-2-enoxy(tripropyl)silane?
3-methylbut-2-enoxy(tripropyl)silane has a molecular weight of 242.48 g/mol, XLogP of 5.14, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylbut-2-enoxy(tripropyl)silane is sourced from PubChem (CID 531303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).