but-3-en-1-ynyl(trimethyl)silane

C7H12Si — CID 572885

IUPACbut-3-en-1-ynyl(trimethyl)silane
SMILESC=CC#C[Si](C)(C)C
InChIInChI=1S/C7H12Si/c1-5-6-7-8(2,3)4/h5H,1H2,2-4H3
InChIKeyJIVAZVHJSBZWEE-UHFFFAOYSA-N
MW124.26 g/mol
LogP2.05
Rot. Bonds

About but-3-en-1-ynyl(trimethyl)silane

but-3-en-1-ynyl(trimethyl)silane (PubChem CID 572885) has the molecular formula C7H12Si and a molecular weight of 124.26 g/mol. Its IUPAC name is but-3-en-1-ynyl(trimethyl)silane.

Molecular Properties

Compound Namebut-3-en-1-ynyl(trimethyl)silane
PubChem CID572885
Molecular FormulaC7H12Si
Molecular Weight124.26 g/mol
Exact Mass124.07
IUPAC Namebut-3-en-1-ynyl(trimethyl)silane
SMILESC=CC#C[Si](C)(C)C
InChIInChI=1S/C7H12Si/c1-5-6-7-8(2,3)4/h5H,1H2,2-4H3
InChIKeyJIVAZVHJSBZWEE-UHFFFAOYSA-N
XLogP2.05
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.26
LogP ≤ 52.05
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 but-3-en-1-ynyl(trimethyl)silane?
The IUPAC name of but-3-en-1-ynyl(trimethyl)silane (CID 572885) is but-3-en-1-ynyl(trimethyl)silane.
What is the SMILES notation for but-3-en-1-ynyl(trimethyl)silane?
The canonical SMILES for but-3-en-1-ynyl(trimethyl)silane is C=CC#C[Si](C)(C)C.
What is the InChIKey of but-3-en-1-ynyl(trimethyl)silane?
The InChIKey is JIVAZVHJSBZWEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12Si/c1-5-6-7-8(2,3)4/h5H,1H2,2-4H3.
What are the key properties of but-3-en-1-ynyl(trimethyl)silane?
but-3-en-1-ynyl(trimethyl)silane has a molecular weight of 124.26 g/mol, XLogP of 2.05, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for but-3-en-1-ynyl(trimethyl)silane is sourced from PubChem (CID 572885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).