tetrafluoroboranuide; tri-tert-butylphosphane

• ChemBase ID: 180545
• Molecular Formular: C12H27BF4P-
• Molecular Mass: 289.1211538
• Monoisotopic Mass: 289.18795577
• SMILES: [B-](F)(F)(F)F.P(C(C)(C)C)(C(C)(C)C)C(C)(C)C
• Canonical SMILES: CC(P(C(C)(C)C)C(C)(C)C)(C)C.F[B-](F)(F)F
• InChI: InChI=1S/C12H27P.BF4/c1-10(2,3)13(11(4,5)6)12(7,8)9;2-1(3,4)5/h1-9H3;/q;-1
• InChIKey: YTJUCJAUJCXFTN-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: tetrafluoroboranuide; tri-tert-butylphosphane
• IUPAC Traditional name: tri-tert-butylphosphane tetrafluoroborate
• Synonyms: Tri-tert-butylphosphine tetrafluoroborate

Database IDs

• CAS Number: 131274-22-1
• PubChem SID: 164236455
• PubChem CID: 44558591

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 2.3845654
• LogD (pH = 7.4): 2.3847759
• Log P: 2.5937
• Molar Refractivity: 68.517 cm^3
• Polarizability: 25.590317 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: true