tert-butyl-[dibromo(fluoro)methyl]-dimethylsilane

C7H15Br2FSi — CID 10892104

IUPACtert-butyl-[dibromo(fluoro)methyl]-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)C(F)(Br)Br
InChIInChI=1S/C7H15Br2FSi/c1-6(2,3)11(4,5)7(8,9)10/h1-5H3
InChIKeyNIKKRZKGTMUNFJ-UHFFFAOYSA-N
MW306.09 g/mol
LogP4.45
Rot. Bonds1

About tert-butyl-[dibromo(fluoro)methyl]-dimethylsilane

tert-butyl-[dibromo(fluoro)methyl]-dimethylsilane (PubChem CID 10892104) has the molecular formula C7H15Br2FSi and a molecular weight of 306.09 g/mol. Its IUPAC name is tert-butyl-[dibromo(fluoro)methyl]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[dibromo(fluoro)methyl]-dimethylsilane
PubChem CID10892104
Molecular FormulaC7H15Br2FSi
Molecular Weight306.09 g/mol
Exact Mass303.93
IUPAC Nametert-butyl-[dibromo(fluoro)methyl]-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)C(F)(Br)Br
InChIInChI=1S/C7H15Br2FSi/c1-6(2,3)11(4,5)7(8,9)10/h1-5H3
InChIKeyNIKKRZKGTMUNFJ-UHFFFAOYSA-N
XLogP4.45
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.09
LogP ≤ 54.45
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 tert-butyl-[dibromo(fluoro)methyl]-dimethylsilane?
The IUPAC name of tert-butyl-[dibromo(fluoro)methyl]-dimethylsilane (CID 10892104) is tert-butyl-[dibromo(fluoro)methyl]-dimethylsilane.
What is the SMILES notation for tert-butyl-[dibromo(fluoro)methyl]-dimethylsilane?
The canonical SMILES for tert-butyl-[dibromo(fluoro)methyl]-dimethylsilane is CC(C)(C)[Si](C)(C)C(F)(Br)Br.
What is the InChIKey of tert-butyl-[dibromo(fluoro)methyl]-dimethylsilane?
The InChIKey is NIKKRZKGTMUNFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15Br2FSi/c1-6(2,3)11(4,5)7(8,9)10/h1-5H3.
What are the key properties of tert-butyl-[dibromo(fluoro)methyl]-dimethylsilane?
tert-butyl-[dibromo(fluoro)methyl]-dimethylsilane has a molecular weight of 306.09 g/mol, XLogP of 4.45, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[dibromo(fluoro)methyl]-dimethylsilane is sourced from PubChem (CID 10892104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).