buta-1,3-diynyl(trimethyl)silane

C7H10Si — CID 572306

IUPACbuta-1,3-diynyl(trimethyl)silane
SMILESC#CC#C[Si](C)(C)C
InChIInChI=1S/C7H10Si/c1-5-6-7-8(2,3)4/h1H,2-4H3
InChIKeyGVCHYDYMLIWQPE-UHFFFAOYSA-N
MW122.24 g/mol
LogP1.50
Rot. Bonds

About buta-1,3-diynyl(trimethyl)silane

buta-1,3-diynyl(trimethyl)silane (PubChem CID 572306) has the molecular formula C7H10Si and a molecular weight of 122.24 g/mol. Its IUPAC name is buta-1,3-diynyl(trimethyl)silane.

Molecular Properties

Compound Namebuta-1,3-diynyl(trimethyl)silane
PubChem CID572306
Molecular FormulaC7H10Si
Molecular Weight122.24 g/mol
Exact Mass122.06
IUPAC Namebuta-1,3-diynyl(trimethyl)silane
SMILESC#CC#C[Si](C)(C)C
InChIInChI=1S/C7H10Si/c1-5-6-7-8(2,3)4/h1H,2-4H3
InChIKeyGVCHYDYMLIWQPE-UHFFFAOYSA-N
XLogP1.50
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.24
LogP ≤ 51.50
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 buta-1,3-diynyl(trimethyl)silane?
The IUPAC name of buta-1,3-diynyl(trimethyl)silane (CID 572306) is buta-1,3-diynyl(trimethyl)silane.
What is the SMILES notation for buta-1,3-diynyl(trimethyl)silane?
The canonical SMILES for buta-1,3-diynyl(trimethyl)silane is C#CC#C[Si](C)(C)C.
What is the InChIKey of buta-1,3-diynyl(trimethyl)silane?
The InChIKey is GVCHYDYMLIWQPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10Si/c1-5-6-7-8(2,3)4/h1H,2-4H3.
What are the key properties of buta-1,3-diynyl(trimethyl)silane?
buta-1,3-diynyl(trimethyl)silane has a molecular weight of 122.24 g/mol, XLogP of 1.50, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for buta-1,3-diynyl(trimethyl)silane is sourced from PubChem (CID 572306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).