trimethyl-[4-[2-(4-trimethylsilylbut-3-ynyl)-1,3-dioxolan-2-yl]but-1-ynyl]silane

C17H30O2Si2 — CID 71681596

IUPACtrimethyl-[4-[2-(4-trimethylsilylbut-3-ynyl)-1,3-dioxolan-2-yl]but-1-ynyl]silane
SMILESC[Si](C)(C)C#CCCC1(CCC#C[Si](C)(C)C)OCCO1
InChIInChI=1S/C17H30O2Si2/c1-20(2,3)15-9-7-11-17(18-13-14-19-17)12-8-10-16-21(4,5)6/h7-8,11-14H2,1-6H3
InChIKeyXBVCDCCXZFZPTH-UHFFFAOYSA-N
MW322.60 g/mol
LogP4.05
Rot. Bonds4

About trimethyl-[4-[2-(4-trimethylsilylbut-3-ynyl)-1,3-dioxolan-2-yl]but-1-ynyl]silane

trimethyl-[4-[2-(4-trimethylsilylbut-3-ynyl)-1,3-dioxolan-2-yl]but-1-ynyl]silane (PubChem CID 71681596) has the molecular formula C17H30O2Si2 and a molecular weight of 322.60 g/mol. Its IUPAC name is trimethyl-[4-[2-(4-trimethylsilylbut-3-ynyl)-1,3-dioxolan-2-yl]but-1-ynyl]silane.

Molecular Properties

Compound Nametrimethyl-[4-[2-(4-trimethylsilylbut-3-ynyl)-1,3-dioxolan-2-yl]but-1-ynyl]silane
PubChem CID71681596
Molecular FormulaC17H30O2Si2
Molecular Weight322.60 g/mol
Exact Mass322.18
IUPAC Nametrimethyl-[4-[2-(4-trimethylsilylbut-3-ynyl)-1,3-dioxolan-2-yl]but-1-ynyl]silane
SMILESC[Si](C)(C)C#CCCC1(CCC#C[Si](C)(C)C)OCCO1
InChIInChI=1S/C17H30O2Si2/c1-20(2,3)15-9-7-11-17(18-13-14-19-17)12-8-10-16-21(4,5)6/h7-8,11-14H2,1-6H3
InChIKeyXBVCDCCXZFZPTH-UHFFFAOYSA-N
XLogP4.05
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.60
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 trimethyl-[4-[2-(4-trimethylsilylbut-3-ynyl)-1,3-dioxolan-2-yl]but-1-ynyl]silane?
The IUPAC name of trimethyl-[4-[2-(4-trimethylsilylbut-3-ynyl)-1,3-dioxolan-2-yl]but-1-ynyl]silane (CID 71681596) is trimethyl-[4-[2-(4-trimethylsilylbut-3-ynyl)-1,3-dioxolan-2-yl]but-1-ynyl]silane.
What is the SMILES notation for trimethyl-[4-[2-(4-trimethylsilylbut-3-ynyl)-1,3-dioxolan-2-yl]but-1-ynyl]silane?
The canonical SMILES for trimethyl-[4-[2-(4-trimethylsilylbut-3-ynyl)-1,3-dioxolan-2-yl]but-1-ynyl]silane is C[Si](C)(C)C#CCCC1(CCC#C[Si](C)(C)C)OCCO1.
What is the InChIKey of trimethyl-[4-[2-(4-trimethylsilylbut-3-ynyl)-1,3-dioxolan-2-yl]but-1-ynyl]silane?
The InChIKey is XBVCDCCXZFZPTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30O2Si2/c1-20(2,3)15-9-7-11-17(18-13-14-19-17)12-8-10-16-21(4,5)6/h7-8,11-14H2,1-6H3.
What are the key properties of trimethyl-[4-[2-(4-trimethylsilylbut-3-ynyl)-1,3-dioxolan-2-yl]but-1-ynyl]silane?
trimethyl-[4-[2-(4-trimethylsilylbut-3-ynyl)-1,3-dioxolan-2-yl]but-1-ynyl]silane has a molecular weight of 322.60 g/mol, XLogP of 4.05, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[4-[2-(4-trimethylsilylbut-3-ynyl)-1,3-dioxolan-2-yl]but-1-ynyl]silane is sourced from PubChem (CID 71681596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).