potassium but-2-en-2-yl(trifluoro)boranuide

C4H7BF3K — CID 122197708

IUPACpotassium but-2-en-2-yl(trifluoro)boranuide
SMILESCC=C(C)[B-](F)(F)F.[K+]
InChIInChI=1S/C4H7BF3.K/c1-3-4(2)5(6,7)8;/h3H,1-2H3;/q-1;+1
InChIKeyIFJZXYDBLMMRCO-UHFFFAOYSA-N
MW162.00 g/mol
LogP-0.66
Rot. Bonds1

About potassium but-2-en-2-yl(trifluoro)boranuide

potassium but-2-en-2-yl(trifluoro)boranuide (PubChem CID 122197708) has the molecular formula C4H7BF3K and a molecular weight of 162.00 g/mol. Its IUPAC name is potassium but-2-en-2-yl(trifluoro)boranuide.

Molecular Properties

Compound Namepotassium but-2-en-2-yl(trifluoro)boranuide
PubChem CID122197708
Molecular FormulaC4H7BF3K
Molecular Weight162.00 g/mol
Exact Mass162.02
IUPAC Namepotassium but-2-en-2-yl(trifluoro)boranuide
SMILESCC=C(C)[B-](F)(F)F.[K+]
InChIInChI=1S/C4H7BF3.K/c1-3-4(2)5(6,7)8;/h3H,1-2H3;/q-1;+1
InChIKeyIFJZXYDBLMMRCO-UHFFFAOYSA-N
XLogP-0.66
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.00
LogP ≤ 5-0.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of potassium but-2-en-2-yl(trifluoro)boranuide?
The IUPAC name of potassium but-2-en-2-yl(trifluoro)boranuide (CID 122197708) is potassium but-2-en-2-yl(trifluoro)boranuide.
What is the SMILES notation for potassium but-2-en-2-yl(trifluoro)boranuide?
The canonical SMILES for potassium but-2-en-2-yl(trifluoro)boranuide is CC=C(C)[B-](F)(F)F.[K+].
What is the InChIKey of potassium but-2-en-2-yl(trifluoro)boranuide?
The InChIKey is IFJZXYDBLMMRCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7BF3.K/c1-3-4(2)5(6,7)8;/h3H,1-2H3;/q-1;+1.
What are the key properties of potassium but-2-en-2-yl(trifluoro)boranuide?
potassium but-2-en-2-yl(trifluoro)boranuide has a molecular weight of 162.00 g/mol, XLogP of -0.66, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for potassium but-2-en-2-yl(trifluoro)boranuide is sourced from PubChem (CID 122197708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).