3-bromoprop-1-enyl-tert-butyl-dimethylsilane

C9H19BrSi — CID 71422698

IUPAC3-bromoprop-1-enyl-tert-butyl-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)C=CCBr
InChIInChI=1S/C9H19BrSi/c1-9(2,3)11(4,5)8-6-7-10/h6,8H,7H2,1-5H3
InChIKeyLZNZINHBEJFQGV-UHFFFAOYSA-N
MW235.24 g/mol
LogP3.99
Rot. Bonds2

About 3-bromoprop-1-enyl-tert-butyl-dimethylsilane

3-bromoprop-1-enyl-tert-butyl-dimethylsilane (PubChem CID 71422698) has the molecular formula C9H19BrSi and a molecular weight of 235.24 g/mol. Its IUPAC name is 3-bromoprop-1-enyl-tert-butyl-dimethylsilane.

Molecular Properties

Compound Name3-bromoprop-1-enyl-tert-butyl-dimethylsilane
PubChem CID71422698
Molecular FormulaC9H19BrSi
Molecular Weight235.24 g/mol
Exact Mass234.04
IUPAC Name3-bromoprop-1-enyl-tert-butyl-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)C=CCBr
InChIInChI=1S/C9H19BrSi/c1-9(2,3)11(4,5)8-6-7-10/h6,8H,7H2,1-5H3
InChIKeyLZNZINHBEJFQGV-UHFFFAOYSA-N
XLogP3.99
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.24
LogP ≤ 53.99
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'}

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Frequently Asked Questions

What is the IUPAC name of 3-bromoprop-1-enyl-tert-butyl-dimethylsilane?
The IUPAC name of 3-bromoprop-1-enyl-tert-butyl-dimethylsilane (CID 71422698) is 3-bromoprop-1-enyl-tert-butyl-dimethylsilane.
What is the SMILES notation for 3-bromoprop-1-enyl-tert-butyl-dimethylsilane?
The canonical SMILES for 3-bromoprop-1-enyl-tert-butyl-dimethylsilane is CC(C)(C)[Si](C)(C)C=CCBr.
What is the InChIKey of 3-bromoprop-1-enyl-tert-butyl-dimethylsilane?
The InChIKey is LZNZINHBEJFQGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19BrSi/c1-9(2,3)11(4,5)8-6-7-10/h6,8H,7H2,1-5H3.
What are the key properties of 3-bromoprop-1-enyl-tert-butyl-dimethylsilane?
3-bromoprop-1-enyl-tert-butyl-dimethylsilane has a molecular weight of 235.24 g/mol, XLogP of 3.99, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromoprop-1-enyl-tert-butyl-dimethylsilane is sourced from PubChem (CID 71422698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).