[(E)-1,4-bis(trimethylsilyl)but-1-en-3-yn-2-yl]-trimethylsilane

C13H28Si3 — CID 13484488

IUPAC[(E)-1,4-bis(trimethylsilyl)but-1-en-3-yn-2-yl]-trimethylsilane
SMILESC[Si](C)(C)C#C/C(=C\[Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C13H28Si3/c1-14(2,3)11-10-13(16(7,8)9)12-15(4,5)6/h12H,1-9H3/b13-12+
InChIKeyUKLDAINLZFHRFH-OUKQBFOZSA-N
MW268.62 g/mol
LogP4.55
Rot. Bonds2

About [(E)-1,4-bis(trimethylsilyl)but-1-en-3-yn-2-yl]-trimethylsilane

[(E)-1,4-bis(trimethylsilyl)but-1-en-3-yn-2-yl]-trimethylsilane (PubChem CID 13484488) has the molecular formula C13H28Si3 and a molecular weight of 268.62 g/mol. Its IUPAC name is [(E)-1,4-bis(trimethylsilyl)but-1-en-3-yn-2-yl]-trimethylsilane.

Molecular Properties

Compound Name[(E)-1,4-bis(trimethylsilyl)but-1-en-3-yn-2-yl]-trimethylsilane
PubChem CID13484488
Molecular FormulaC13H28Si3
Molecular Weight268.62 g/mol
Exact Mass268.15
IUPAC Name[(E)-1,4-bis(trimethylsilyl)but-1-en-3-yn-2-yl]-trimethylsilane
SMILESC[Si](C)(C)C#C/C(=C\[Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C13H28Si3/c1-14(2,3)11-10-13(16(7,8)9)12-15(4,5)6/h12H,1-9H3/b13-12+
InChIKeyUKLDAINLZFHRFH-OUKQBFOZSA-N
XLogP4.55
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.62
LogP ≤ 54.55
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'}

Analyze [(E)-1,4-bis(trimethylsilyl)but-1-en-3-yn-2-yl]-trimethylsilane with MolForge

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

Launch Full Analysis

Related Compounds

2,3-Bis(trimethylsilyl)-1-propene
CID 530291
1,3-Bis(trimethylsilyl)propyne
CID 140859
1,4-Bis(trimethylsilyl)-2-butyne
CID 140858
2,5-Disilahexane, 2,2,5,5-tetramethyl-3,4-dimethylene-
CID 140928
4-Triethylsilylbut-1-en-3-yne
CID 573021
1,6-Bis-(trimethylsilyl)-3-hexen-1,5-diyne
CID 6197793
Silane, (1E)-1-buten-3-yne-1,4-diylbis[trimethyl-
CID 11063365
Trimethyl(penta-3,4-dien-1-ynyl)silane
CID 12670017
Bis-(trimethylsilyl) propylene
CID 54485602
1,3-Di(trimethylsilyl)but-3-en-1-yne
CID 10867265
Hexa-3,4-dien-1-ynyl(trimethyl)silane
CID 12670020
Triethyl(4-trimethylsilylbuta-1,2-dienyl)silane
CID 85767780

Frequently Asked Questions

What is the IUPAC name of [(E)-1,4-bis(trimethylsilyl)but-1-en-3-yn-2-yl]-trimethylsilane?
The IUPAC name of [(E)-1,4-bis(trimethylsilyl)but-1-en-3-yn-2-yl]-trimethylsilane (CID 13484488) is [(E)-1,4-bis(trimethylsilyl)but-1-en-3-yn-2-yl]-trimethylsilane.
What is the SMILES notation for [(E)-1,4-bis(trimethylsilyl)but-1-en-3-yn-2-yl]-trimethylsilane?
The canonical SMILES for [(E)-1,4-bis(trimethylsilyl)but-1-en-3-yn-2-yl]-trimethylsilane is C[Si](C)(C)C#C/C(=C\[Si](C)(C)C)[Si](C)(C)C.
What is the InChIKey of [(E)-1,4-bis(trimethylsilyl)but-1-en-3-yn-2-yl]-trimethylsilane?
The InChIKey is UKLDAINLZFHRFH-OUKQBFOZSA-N. The full InChI is InChI=1S/C13H28Si3/c1-14(2,3)11-10-13(16(7,8)9)12-15(4,5)6/h12H,1-9H3/b13-12+.
What are the key properties of [(E)-1,4-bis(trimethylsilyl)but-1-en-3-yn-2-yl]-trimethylsilane?
[(E)-1,4-bis(trimethylsilyl)but-1-en-3-yn-2-yl]-trimethylsilane has a molecular weight of 268.62 g/mol, XLogP of 4.55, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-1,4-bis(trimethylsilyl)but-1-en-3-yn-2-yl]-trimethylsilane is sourced from PubChem (CID 13484488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).