2-difluoroboranylethynyl(trimethyl)silane

C5H9BF2Si — CID 14932653

IUPAC2-difluoroboranylethynyl(trimethyl)silane
SMILESC[Si](C)(C)C#CB(F)F
InChIInChI=1S/C5H9BF2Si/c1-9(2,3)5-4-6(7)8/h1-3H3
InChIKeyNYJXWFQDKMFDPL-UHFFFAOYSA-N
MW146.02 g/mol
LogP1.83
Rot. Bonds

About 2-difluoroboranylethynyl(trimethyl)silane

2-difluoroboranylethynyl(trimethyl)silane (PubChem CID 14932653) has the molecular formula C5H9BF2Si and a molecular weight of 146.02 g/mol. Its IUPAC name is 2-difluoroboranylethynyl(trimethyl)silane.

Molecular Properties

Compound Name2-difluoroboranylethynyl(trimethyl)silane
PubChem CID14932653
Molecular FormulaC5H9BF2Si
Molecular Weight146.02 g/mol
Exact Mass146.05
IUPAC Name2-difluoroboranylethynyl(trimethyl)silane
SMILESC[Si](C)(C)C#CB(F)F
InChIInChI=1S/C5H9BF2Si/c1-9(2,3)5-4-6(7)8/h1-3H3
InChIKeyNYJXWFQDKMFDPL-UHFFFAOYSA-N
XLogP1.83
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.02
LogP ≤ 51.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

Potassium trifluoro[2-(trimethylsilyl)ethynyl]boranuide
CID 23673582
Trifluoro(2-trimethylsilylethynyl)boranuide
CID 11095714
Potassium trifluoro(2-triethylsilylethynyl)boranuide
CID 23702896
Trifluoro(2-triethylsilylethynyl)boranuide
CID 10514540
Trifluoro(2-trimethylsilylethyl)boranuide
CID 133613490
Trifluoro(3-trimethylsilylpropyl)boranuide
CID 155819800
Trifluoro(3-trimethylsilylprop-2-ynyl)boranuide
CID 165984010
Potassium trifluoro[2-(trimethylsilyl)ethyl]boranuide
CID 133613489

Frequently Asked Questions

What is the IUPAC name of 2-difluoroboranylethynyl(trimethyl)silane?
The IUPAC name of 2-difluoroboranylethynyl(trimethyl)silane (CID 14932653) is 2-difluoroboranylethynyl(trimethyl)silane.
What is the SMILES notation for 2-difluoroboranylethynyl(trimethyl)silane?
The canonical SMILES for 2-difluoroboranylethynyl(trimethyl)silane is C[Si](C)(C)C#CB(F)F.
What is the InChIKey of 2-difluoroboranylethynyl(trimethyl)silane?
The InChIKey is NYJXWFQDKMFDPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9BF2Si/c1-9(2,3)5-4-6(7)8/h1-3H3.
What are the key properties of 2-difluoroboranylethynyl(trimethyl)silane?
2-difluoroboranylethynyl(trimethyl)silane has a molecular weight of 146.02 g/mol, XLogP of 1.83, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-difluoroboranylethynyl(trimethyl)silane is sourced from PubChem (CID 14932653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).