(1,2-dibromo-1,2,2-trifluoroethyl)-trimethylsilane

C5H9Br2F3Si — CID 15828576

IUPAC(1,2-dibromo-1,2,2-trifluoroethyl)-trimethylsilane
SMILESC[Si](C)(C)C(F)(Br)C(F)(F)Br
InChIInChI=1S/C5H9Br2F3Si/c1-11(2,3)5(7,10)4(6,8)9/h1-3H3
InChIKeyUKVGKULXYWZODZ-UHFFFAOYSA-N
MW314.02 g/mol
LogP3.91
Rot. Bonds2

About (1,2-dibromo-1,2,2-trifluoroethyl)-trimethylsilane

(1,2-dibromo-1,2,2-trifluoroethyl)-trimethylsilane (PubChem CID 15828576) has the molecular formula C5H9Br2F3Si and a molecular weight of 314.02 g/mol. Its IUPAC name is (1,2-dibromo-1,2,2-trifluoroethyl)-trimethylsilane.

Molecular Properties

Compound Name(1,2-dibromo-1,2,2-trifluoroethyl)-trimethylsilane
PubChem CID15828576
Molecular FormulaC5H9Br2F3Si
Molecular Weight314.02 g/mol
Exact Mass311.88
IUPAC Name(1,2-dibromo-1,2,2-trifluoroethyl)-trimethylsilane
SMILESC[Si](C)(C)C(F)(Br)C(F)(F)Br
InChIInChI=1S/C5H9Br2F3Si/c1-11(2,3)5(7,10)4(6,8)9/h1-3H3
InChIKeyUKVGKULXYWZODZ-UHFFFAOYSA-N
XLogP3.91
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.02
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'}

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Frequently Asked Questions

What is the IUPAC name of (1,2-dibromo-1,2,2-trifluoroethyl)-trimethylsilane?
The IUPAC name of (1,2-dibromo-1,2,2-trifluoroethyl)-trimethylsilane (CID 15828576) is (1,2-dibromo-1,2,2-trifluoroethyl)-trimethylsilane.
What is the SMILES notation for (1,2-dibromo-1,2,2-trifluoroethyl)-trimethylsilane?
The canonical SMILES for (1,2-dibromo-1,2,2-trifluoroethyl)-trimethylsilane is C[Si](C)(C)C(F)(Br)C(F)(F)Br.
What is the InChIKey of (1,2-dibromo-1,2,2-trifluoroethyl)-trimethylsilane?
The InChIKey is UKVGKULXYWZODZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9Br2F3Si/c1-11(2,3)5(7,10)4(6,8)9/h1-3H3.
What are the key properties of (1,2-dibromo-1,2,2-trifluoroethyl)-trimethylsilane?
(1,2-dibromo-1,2,2-trifluoroethyl)-trimethylsilane has a molecular weight of 314.02 g/mol, XLogP of 3.91, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1,2-dibromo-1,2,2-trifluoroethyl)-trimethylsilane is sourced from PubChem (CID 15828576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).