trimethyl-[1-[tris(2-methylbut-3-yn-2-yloxy)silyl]ethyl]silane

C20H34O3Si2 — CID 57075904

IUPACtrimethyl-[1-[tris(2-methylbut-3-yn-2-yloxy)silyl]ethyl]silane
SMILESC#CC(C)(C)O[Si](OC(C)(C)C#C)(OC(C)(C)C#C)C(C)[Si](C)(C)C
InChIInChI=1S/C20H34O3Si2/c1-14-18(5,6)21-25(17(4)24(11,12)13,22-19(7,8)15-2)23-20(9,10)16-3/h1-3,17H,4-13H3
InChIKeyKXLCRBVLGDRWOJ-UHFFFAOYSA-N
MW378.66 g/mol
LogP4.48
Rot. Bonds8

About trimethyl-[1-[tris(2-methylbut-3-yn-2-yloxy)silyl]ethyl]silane

trimethyl-[1-[tris(2-methylbut-3-yn-2-yloxy)silyl]ethyl]silane (PubChem CID 57075904) has the molecular formula C20H34O3Si2 and a molecular weight of 378.66 g/mol. Its IUPAC name is trimethyl-[1-[tris(2-methylbut-3-yn-2-yloxy)silyl]ethyl]silane.

Molecular Properties

Compound Nametrimethyl-[1-[tris(2-methylbut-3-yn-2-yloxy)silyl]ethyl]silane
PubChem CID57075904
Molecular FormulaC20H34O3Si2
Molecular Weight378.66 g/mol
Exact Mass378.20
IUPAC Nametrimethyl-[1-[tris(2-methylbut-3-yn-2-yloxy)silyl]ethyl]silane
SMILESC#CC(C)(C)O[Si](OC(C)(C)C#C)(OC(C)(C)C#C)C(C)[Si](C)(C)C
InChIInChI=1S/C20H34O3Si2/c1-14-18(5,6)21-25(17(4)24(11,12)13,22-19(7,8)15-2)23-20(9,10)16-3/h1-3,17H,4-13H3
InChIKeyKXLCRBVLGDRWOJ-UHFFFAOYSA-N
XLogP4.48
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.66
LogP ≤ 54.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze trimethyl-[1-[tris(2-methylbut-3-yn-2-yloxy)silyl]ethyl]silane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of trimethyl-[1-[tris(2-methylbut-3-yn-2-yloxy)silyl]ethyl]silane?
The IUPAC name of trimethyl-[1-[tris(2-methylbut-3-yn-2-yloxy)silyl]ethyl]silane (CID 57075904) is trimethyl-[1-[tris(2-methylbut-3-yn-2-yloxy)silyl]ethyl]silane.
What is the SMILES notation for trimethyl-[1-[tris(2-methylbut-3-yn-2-yloxy)silyl]ethyl]silane?
The canonical SMILES for trimethyl-[1-[tris(2-methylbut-3-yn-2-yloxy)silyl]ethyl]silane is C#CC(C)(C)O[Si](OC(C)(C)C#C)(OC(C)(C)C#C)C(C)[Si](C)(C)C.
What is the InChIKey of trimethyl-[1-[tris(2-methylbut-3-yn-2-yloxy)silyl]ethyl]silane?
The InChIKey is KXLCRBVLGDRWOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H34O3Si2/c1-14-18(5,6)21-25(17(4)24(11,12)13,22-19(7,8)15-2)23-20(9,10)16-3/h1-3,17H,4-13H3.
What are the key properties of trimethyl-[1-[tris(2-methylbut-3-yn-2-yloxy)silyl]ethyl]silane?
trimethyl-[1-[tris(2-methylbut-3-yn-2-yloxy)silyl]ethyl]silane has a molecular weight of 378.66 g/mol, XLogP of 4.48, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[1-[tris(2-methylbut-3-yn-2-yloxy)silyl]ethyl]silane is sourced from PubChem (CID 57075904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).