Tert-butyl(4-tert-butylphenyl)phosphinic fluoride

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Basic information

CAS: 55236-57-2
Standard SMILES: CC(C)(C)c1ccc(P(=O)(F)C(C)(C)C)cc1
InChIKey: KHWYELUYVLSFDE-UHFFFAOYSA-N
Molecular formula: C14H22FOP
Average molar mass: 256.3 g/mol
Monoisotopic mass: 256.13923048

Names & identifiers

Preferred name: Tert-butyl(4-tert-butylphenyl)phosphinic fluoride
IUPAC: 1-tert-butyl-4-[tert-butyl(fluoro)phosphoryl]benzene

Names & synonyms

55236-57-2tert-butyl(4-tert-butylphenyl)phosphinic fluorideNSC137644DTXSID10300583NSC-137644DS-0081251-(fluoro-tert-butyl-phosphoryl)-4-tert-butyl-benzene

Database identifiers

CAS: 55236-57-2
PubChem CID: 283270
DTXSID: DTXSID10300583

Properties

Computed structural properties

XLogP: 4.1
Topological polar surface area: 17.1 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 3
Heavy atoms: 17
Formal charge: 0
Complexity: 303

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Compound notes

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