tert-butyl-dimethyl-(3-trimethylsilylbut-3-en-1-ynyl)silane

C13H26Si2 — CID 102034042

IUPACtert-butyl-dimethyl-(3-trimethylsilylbut-3-en-1-ynyl)silane
SMILESC=C(C#C[Si](C)(C)C(C)(C)C)[Si](C)(C)C
InChIInChI=1S/C13H26Si2/c1-12(14(5,6)7)10-11-15(8,9)13(2,3)4/h1H2,2-9H3
InChIKeyBGIRAVWIHIPGPU-UHFFFAOYSA-N
MW238.52 g/mol
LogP4.47
Rot. Bonds1

About tert-butyl-dimethyl-(3-trimethylsilylbut-3-en-1-ynyl)silane

tert-butyl-dimethyl-(3-trimethylsilylbut-3-en-1-ynyl)silane (PubChem CID 102034042) has the molecular formula C13H26Si2 and a molecular weight of 238.52 g/mol. Its IUPAC name is tert-butyl-dimethyl-(3-trimethylsilylbut-3-en-1-ynyl)silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-(3-trimethylsilylbut-3-en-1-ynyl)silane
PubChem CID102034042
Molecular FormulaC13H26Si2
Molecular Weight238.52 g/mol
Exact Mass238.16
IUPAC Nametert-butyl-dimethyl-(3-trimethylsilylbut-3-en-1-ynyl)silane
SMILESC=C(C#C[Si](C)(C)C(C)(C)C)[Si](C)(C)C
InChIInChI=1S/C13H26Si2/c1-12(14(5,6)7)10-11-15(8,9)13(2,3)4/h1H2,2-9H3
InChIKeyBGIRAVWIHIPGPU-UHFFFAOYSA-N
XLogP4.47
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.52
LogP ≤ 54.47
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 tert-butyl-dimethyl-(3-trimethylsilylbut-3-en-1-ynyl)silane?
The IUPAC name of tert-butyl-dimethyl-(3-trimethylsilylbut-3-en-1-ynyl)silane (CID 102034042) is tert-butyl-dimethyl-(3-trimethylsilylbut-3-en-1-ynyl)silane.
What is the SMILES notation for tert-butyl-dimethyl-(3-trimethylsilylbut-3-en-1-ynyl)silane?
The canonical SMILES for tert-butyl-dimethyl-(3-trimethylsilylbut-3-en-1-ynyl)silane is C=C(C#C[Si](C)(C)C(C)(C)C)[Si](C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-(3-trimethylsilylbut-3-en-1-ynyl)silane?
The InChIKey is BGIRAVWIHIPGPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26Si2/c1-12(14(5,6)7)10-11-15(8,9)13(2,3)4/h1H2,2-9H3.
What are the key properties of tert-butyl-dimethyl-(3-trimethylsilylbut-3-en-1-ynyl)silane?
tert-butyl-dimethyl-(3-trimethylsilylbut-3-en-1-ynyl)silane has a molecular weight of 238.52 g/mol, XLogP of 4.47, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-(3-trimethylsilylbut-3-en-1-ynyl)silane is sourced from PubChem (CID 102034042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).