potassium;hydride;2-phenylethanol;tritetrafluoroborate

C8H11B3F12KO-3 — CID 173023580

IUPACpotassium;hydride;2-phenylethanol;tritetrafluoroborate
SMILESF[B-](F)(F)F.F[B-](F)(F)F.F[B-](F)(F)F.OCCc1ccccc1.[H-].[K+]
InChIInChI=1S/C8H10O.3BF4.K.H/c9-7-6-8-4-2-1-3-5-8;3*2-1(3,4)5;;/h1-5,9H,6-7H2;;;;;/q;3*-1;+1;-1
InChIKeyVIHXZJHPHBRFQG-UHFFFAOYSA-N
MW422.69 g/mol
LogP2.24
Rot. Bonds2

About potassium;hydride;2-phenylethanol;tritetrafluoroborate

potassium;hydride;2-phenylethanol;tritetrafluoroborate (PubChem CID 173023580) has the molecular formula C8H11B3F12KO-3 and a molecular weight of 422.69 g/mol. Its IUPAC name is potassium;hydride;2-phenylethanol;tritetrafluoroborate.

Molecular Properties

Compound Namepotassium;hydride;2-phenylethanol;tritetrafluoroborate
PubChem CID173023580
Molecular FormulaC8H11B3F12KO-3
Molecular Weight422.69 g/mol
Exact Mass423.06
IUPAC Namepotassium;hydride;2-phenylethanol;tritetrafluoroborate
SMILESF[B-](F)(F)F.F[B-](F)(F)F.F[B-](F)(F)F.OCCc1ccccc1.[H-].[K+]
InChIInChI=1S/C8H10O.3BF4.K.H/c9-7-6-8-4-2-1-3-5-8;3*2-1(3,4)5;;/h1-5,9H,6-7H2;;;;;/q;3*-1;+1;-1
InChIKeyVIHXZJHPHBRFQG-UHFFFAOYSA-N
XLogP2.24
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.69
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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;hydride;2-phenylethanol;tritetrafluoroborate?
The IUPAC name of potassium;hydride;2-phenylethanol;tritetrafluoroborate (CID 173023580) is potassium;hydride;2-phenylethanol;tritetrafluoroborate.
What is the SMILES notation for potassium;hydride;2-phenylethanol;tritetrafluoroborate?
The canonical SMILES for potassium;hydride;2-phenylethanol;tritetrafluoroborate is F[B-](F)(F)F.F[B-](F)(F)F.F[B-](F)(F)F.OCCc1ccccc1.[H-].[K+].
What is the InChIKey of potassium;hydride;2-phenylethanol;tritetrafluoroborate?
The InChIKey is VIHXZJHPHBRFQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10O.3BF4.K.H/c9-7-6-8-4-2-1-3-5-8;3*2-1(3,4)5;;/h1-5,9H,6-7H2;;;;;/q;3*-1;+1;-1.
What are the key properties of potassium;hydride;2-phenylethanol;tritetrafluoroborate?
potassium;hydride;2-phenylethanol;tritetrafluoroborate has a molecular weight of 422.69 g/mol, XLogP of 2.24, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;hydride;2-phenylethanol;tritetrafluoroborate is sourced from PubChem (CID 173023580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).