1-bromobut-3-enyl(dimethyl)silane

C6H13BrSi — CID 173162120

IUPAC1-bromobut-3-enyl(dimethyl)silane
SMILESC=CCC(Br)[SiH](C)C
InChIInChI=1S/C6H13BrSi/c1-4-5-6(7)8(2)3/h4,6,8H,1,5H2,2-3H3
InChIKeyCHQXQSDXLQPEGS-UHFFFAOYSA-N
MW193.16 g/mol
LogP2.35
Rot. Bonds3

About 1-bromobut-3-enyl(dimethyl)silane

1-bromobut-3-enyl(dimethyl)silane (PubChem CID 173162120) has the molecular formula C6H13BrSi and a molecular weight of 193.16 g/mol. Its IUPAC name is 1-bromobut-3-enyl(dimethyl)silane.

Molecular Properties

Compound Name1-bromobut-3-enyl(dimethyl)silane
PubChem CID173162120
Molecular FormulaC6H13BrSi
Molecular Weight193.16 g/mol
Exact Mass192.00
IUPAC Name1-bromobut-3-enyl(dimethyl)silane
SMILESC=CCC(Br)[SiH](C)C
InChIInChI=1S/C6H13BrSi/c1-4-5-6(7)8(2)3/h4,6,8H,1,5H2,2-3H3
InChIKeyCHQXQSDXLQPEGS-UHFFFAOYSA-N
XLogP2.35
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.16
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-bromobut-3-enyl(dimethyl)silane?
The IUPAC name of 1-bromobut-3-enyl(dimethyl)silane (CID 173162120) is 1-bromobut-3-enyl(dimethyl)silane.
What is the SMILES notation for 1-bromobut-3-enyl(dimethyl)silane?
The canonical SMILES for 1-bromobut-3-enyl(dimethyl)silane is C=CCC(Br)[SiH](C)C.
What is the InChIKey of 1-bromobut-3-enyl(dimethyl)silane?
The InChIKey is CHQXQSDXLQPEGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13BrSi/c1-4-5-6(7)8(2)3/h4,6,8H,1,5H2,2-3H3.
What are the key properties of 1-bromobut-3-enyl(dimethyl)silane?
1-bromobut-3-enyl(dimethyl)silane has a molecular weight of 193.16 g/mol, XLogP of 2.35, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromobut-3-enyl(dimethyl)silane is sourced from PubChem (CID 173162120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).