ethynyl-tri(propan-2-yl)silane

C11H22Si — CID 2734682

IUPACethynyl-tri(propan-2-yl)silane
SMILESC#C[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C11H22Si/c1-8-12(9(2)3,10(4)5)11(6)7/h1,9-11H,2-7H3
InChIKeyKZGWPHUWNWRTEP-UHFFFAOYSA-N
MW182.38 g/mol
LogP3.84
Rot. Bonds3

About ethynyl-tri(propan-2-yl)silane

ethynyl-tri(propan-2-yl)silane (PubChem CID 2734682) has the molecular formula C11H22Si and a molecular weight of 182.38 g/mol. Its IUPAC name is ethynyl-tri(propan-2-yl)silane.

Molecular Properties

Compound Nameethynyl-tri(propan-2-yl)silane
PubChem CID2734682
Molecular FormulaC11H22Si
Molecular Weight182.38 g/mol
Exact Mass182.15
IUPAC Nameethynyl-tri(propan-2-yl)silane
SMILESC#C[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C11H22Si/c1-8-12(9(2)3,10(4)5)11(6)7/h1,9-11H,2-7H3
InChIKeyKZGWPHUWNWRTEP-UHFFFAOYSA-N
XLogP3.84
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.38
LogP ≤ 53.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 ethynyl-tri(propan-2-yl)silane?
The IUPAC name of ethynyl-tri(propan-2-yl)silane (CID 2734682) is ethynyl-tri(propan-2-yl)silane.
What is the SMILES notation for ethynyl-tri(propan-2-yl)silane?
The canonical SMILES for ethynyl-tri(propan-2-yl)silane is C#C[Si](C(C)C)(C(C)C)C(C)C.
What is the InChIKey of ethynyl-tri(propan-2-yl)silane?
The InChIKey is KZGWPHUWNWRTEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22Si/c1-8-12(9(2)3,10(4)5)11(6)7/h1,9-11H,2-7H3.
What are the key properties of ethynyl-tri(propan-2-yl)silane?
ethynyl-tri(propan-2-yl)silane has a molecular weight of 182.38 g/mol, XLogP of 3.84, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethynyl-tri(propan-2-yl)silane is sourced from PubChem (CID 2734682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).