potassium tert-butyltrifluoroboranuide

• ChemBase ID: 235074
• Molecular Formular: C4H9BF3K
• Molecular Mass: 164.0187696
• Monoisotopic Mass: 164.03864703
• SMILES: [B-](C(C)(C)C)(F)(F)F.[K+]
• Canonical SMILES: F[B-](C(C)(C)C)(F)F.[K+]
• InChI: InChI=1S/C4H9BF3.K/c1-4(2,3)5(6,7)8;/h1-3H3;/q-1;+1
• InChIKey: DUBQQKQAMBSJQA-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: potassium tert-butyltrifluoroboranuide
• IUPAC Traditional name: potassium tert-butyltrifluoroboranuide
• Synonyms: potassium tert-butyltrifluoroboranuide

Database IDs

• MDL Number: MFCD09992886
• PubChem SID: 164290984
• PubChem CID: 63702250

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 1.9325
• LogD (pH = 7.4): 1.9325
• Log P: 1.9325
• Molar Refractivity: 23.3132 cm^3
• Polarizability: 9.755165 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 0.797

Product Information

• Purity: 95%