tert-butyl-dimethyl-penta-2,4-diynoxysilane

C11H18OSi — CID 11252555

IUPACtert-butyl-dimethyl-penta-2,4-diynoxysilane
SMILESC#CC#CCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C11H18OSi/c1-7-8-9-10-12-13(5,6)11(2,3)4/h1H,10H2,2-6H3
InChIKeyAQOMCXLZSQNHAD-UHFFFAOYSA-N
MW194.35 g/mol
LogP2.64
Rot. Bonds2

About tert-butyl-dimethyl-penta-2,4-diynoxysilane

tert-butyl-dimethyl-penta-2,4-diynoxysilane (PubChem CID 11252555) has the molecular formula C11H18OSi and a molecular weight of 194.35 g/mol. Its IUPAC name is tert-butyl-dimethyl-penta-2,4-diynoxysilane.

Molecular Properties

Compound Nametert-butyl-dimethyl-penta-2,4-diynoxysilane
PubChem CID11252555
Molecular FormulaC11H18OSi
Molecular Weight194.35 g/mol
Exact Mass194.11
IUPAC Nametert-butyl-dimethyl-penta-2,4-diynoxysilane
SMILESC#CC#CCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C11H18OSi/c1-7-8-9-10-12-13(5,6)11(2,3)4/h1H,10H2,2-6H3
InChIKeyAQOMCXLZSQNHAD-UHFFFAOYSA-N
XLogP2.64
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.35
LogP ≤ 52.64
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 tert-butyl-dimethyl-penta-2,4-diynoxysilane?
The IUPAC name of tert-butyl-dimethyl-penta-2,4-diynoxysilane (CID 11252555) is tert-butyl-dimethyl-penta-2,4-diynoxysilane.
What is the SMILES notation for tert-butyl-dimethyl-penta-2,4-diynoxysilane?
The canonical SMILES for tert-butyl-dimethyl-penta-2,4-diynoxysilane is C#CC#CCO[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-penta-2,4-diynoxysilane?
The InChIKey is AQOMCXLZSQNHAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18OSi/c1-7-8-9-10-12-13(5,6)11(2,3)4/h1H,10H2,2-6H3.
What are the key properties of tert-butyl-dimethyl-penta-2,4-diynoxysilane?
tert-butyl-dimethyl-penta-2,4-diynoxysilane has a molecular weight of 194.35 g/mol, XLogP of 2.64, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-penta-2,4-diynoxysilane is sourced from PubChem (CID 11252555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).