2-(bromomethyl)pent-4-enyl-trimethylsilane

C9H19BrSi — CID 165446042

IUPAC2-(bromomethyl)pent-4-enyl-trimethylsilane
SMILESC=CCC(CBr)C[Si](C)(C)C
InChIInChI=1S/C9H19BrSi/c1-5-6-9(7-10)8-11(2,3)4/h5,9H,1,6-8H2,2-4H3
InChIKeyCBZOEHOADMKRJK-UHFFFAOYSA-N
MW235.24 g/mol
LogP3.91
Rot. Bonds5

About 2-(bromomethyl)pent-4-enyl-trimethylsilane

2-(bromomethyl)pent-4-enyl-trimethylsilane (PubChem CID 165446042) has the molecular formula C9H19BrSi and a molecular weight of 235.24 g/mol. Its IUPAC name is 2-(bromomethyl)pent-4-enyl-trimethylsilane.

Molecular Properties

Compound Name2-(bromomethyl)pent-4-enyl-trimethylsilane
PubChem CID165446042
Molecular FormulaC9H19BrSi
Molecular Weight235.24 g/mol
Exact Mass234.04
IUPAC Name2-(bromomethyl)pent-4-enyl-trimethylsilane
SMILESC=CCC(CBr)C[Si](C)(C)C
InChIInChI=1S/C9H19BrSi/c1-5-6-9(7-10)8-11(2,3)4/h5,9H,1,6-8H2,2-4H3
InChIKeyCBZOEHOADMKRJK-UHFFFAOYSA-N
XLogP3.91
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.24
LogP ≤ 53.91
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 2-(bromomethyl)pent-4-enyl-trimethylsilane?
The IUPAC name of 2-(bromomethyl)pent-4-enyl-trimethylsilane (CID 165446042) is 2-(bromomethyl)pent-4-enyl-trimethylsilane.
What is the SMILES notation for 2-(bromomethyl)pent-4-enyl-trimethylsilane?
The canonical SMILES for 2-(bromomethyl)pent-4-enyl-trimethylsilane is C=CCC(CBr)C[Si](C)(C)C.
What is the InChIKey of 2-(bromomethyl)pent-4-enyl-trimethylsilane?
The InChIKey is CBZOEHOADMKRJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19BrSi/c1-5-6-9(7-10)8-11(2,3)4/h5,9H,1,6-8H2,2-4H3.
What are the key properties of 2-(bromomethyl)pent-4-enyl-trimethylsilane?
2-(bromomethyl)pent-4-enyl-trimethylsilane has a molecular weight of 235.24 g/mol, XLogP of 3.91, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(bromomethyl)pent-4-enyl-trimethylsilane is sourced from PubChem (CID 165446042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).