2-methylbut-3-ynoxysilane

C5H10OSi — CID 150567170

IUPAC2-methylbut-3-ynoxysilane
SMILESC#CC(C)CO[SiH3]
InChIInChI=1S/C5H10OSi/c1-3-5(2)4-6-7/h1,5H,4H2,2,7H3
InChIKeyILBKTFYGRFKJSI-UHFFFAOYSA-N
MW114.22 g/mol
LogP-0.45
Rot. Bonds2

About 2-methylbut-3-ynoxysilane

2-methylbut-3-ynoxysilane (PubChem CID 150567170) has the molecular formula C5H10OSi and a molecular weight of 114.22 g/mol. Its IUPAC name is 2-methylbut-3-ynoxysilane.

Molecular Properties

Compound Name2-methylbut-3-ynoxysilane
PubChem CID150567170
Molecular FormulaC5H10OSi
Molecular Weight114.22 g/mol
Exact Mass114.05
IUPAC Name2-methylbut-3-ynoxysilane
SMILESC#CC(C)CO[SiH3]
InChIInChI=1S/C5H10OSi/c1-3-5(2)4-6-7/h1,5H,4H2,2,7H3
InChIKeyILBKTFYGRFKJSI-UHFFFAOYSA-N
XLogP-0.45
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.22
LogP ≤ 5-0.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-methylbut-3-ynoxysilane?
The IUPAC name of 2-methylbut-3-ynoxysilane (CID 150567170) is 2-methylbut-3-ynoxysilane.
What is the SMILES notation for 2-methylbut-3-ynoxysilane?
The canonical SMILES for 2-methylbut-3-ynoxysilane is C#CC(C)CO[SiH3].
What is the InChIKey of 2-methylbut-3-ynoxysilane?
The InChIKey is ILBKTFYGRFKJSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10OSi/c1-3-5(2)4-6-7/h1,5H,4H2,2,7H3.
What are the key properties of 2-methylbut-3-ynoxysilane?
2-methylbut-3-ynoxysilane has a molecular weight of 114.22 g/mol, XLogP of -0.45, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylbut-3-ynoxysilane is sourced from PubChem (CID 150567170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).