4,4-dibromobut-3-en-1-ynyl(trimethyl)silane

C7H10Br2Si — CID 10731564

IUPAC4,4-dibromobut-3-en-1-ynyl(trimethyl)silane
SMILESC[Si](C)(C)C#CC=C(Br)Br
InChIInChI=1S/C7H10Br2Si/c1-10(2,3)6-4-5-7(8)9/h5H,1-3H3
InChIKeyOJSYQPPRRFFPEM-UHFFFAOYSA-N
MW282.05 g/mol
LogP3.50
Rot. Bonds

About 4,4-dibromobut-3-en-1-ynyl(trimethyl)silane

4,4-dibromobut-3-en-1-ynyl(trimethyl)silane (PubChem CID 10731564) has the molecular formula C7H10Br2Si and a molecular weight of 282.05 g/mol. Its IUPAC name is 4,4-dibromobut-3-en-1-ynyl(trimethyl)silane.

Molecular Properties

Compound Name4,4-dibromobut-3-en-1-ynyl(trimethyl)silane
PubChem CID10731564
Molecular FormulaC7H10Br2Si
Molecular Weight282.05 g/mol
Exact Mass279.89
IUPAC Name4,4-dibromobut-3-en-1-ynyl(trimethyl)silane
SMILESC[Si](C)(C)C#CC=C(Br)Br
InChIInChI=1S/C7H10Br2Si/c1-10(2,3)6-4-5-7(8)9/h5H,1-3H3
InChIKeyOJSYQPPRRFFPEM-UHFFFAOYSA-N
XLogP3.50
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.05
LogP ≤ 53.50
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 4,4-dibromobut-3-en-1-ynyl(trimethyl)silane?
The IUPAC name of 4,4-dibromobut-3-en-1-ynyl(trimethyl)silane (CID 10731564) is 4,4-dibromobut-3-en-1-ynyl(trimethyl)silane.
What is the SMILES notation for 4,4-dibromobut-3-en-1-ynyl(trimethyl)silane?
The canonical SMILES for 4,4-dibromobut-3-en-1-ynyl(trimethyl)silane is C[Si](C)(C)C#CC=C(Br)Br.
What is the InChIKey of 4,4-dibromobut-3-en-1-ynyl(trimethyl)silane?
The InChIKey is OJSYQPPRRFFPEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10Br2Si/c1-10(2,3)6-4-5-7(8)9/h5H,1-3H3.
What are the key properties of 4,4-dibromobut-3-en-1-ynyl(trimethyl)silane?
4,4-dibromobut-3-en-1-ynyl(trimethyl)silane has a molecular weight of 282.05 g/mol, XLogP of 3.50, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-dibromobut-3-en-1-ynyl(trimethyl)silane is sourced from PubChem (CID 10731564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).