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CAS 78-33-1

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Phenol, 4-(1,1-dimethylethyl)-, 1,1′,1′′-phosphate

Description:
Phenol, 4-(1,1-dimethylethyl)-, 1,1′,1′′-phosphate, commonly known as tert-butylphenyl phosphate (TBPP), is an organophosphate compound characterized by its phosphate ester structure. It features a phenolic ring substituted with a tert-butyl group at the para position, which enhances its hydrophobic properties. TBPP is typically a colorless to pale yellow liquid with a characteristic odor. It is soluble in organic solvents but has limited solubility in water, making it useful in various applications, including as a plasticizer and flame retardant in polymers. The compound exhibits moderate toxicity and can pose environmental risks, particularly to aquatic life. Its chemical stability allows it to persist in the environment, raising concerns regarding bioaccumulation. TBPP is also used in the formulation of hydraulic fluids and as a lubricant additive. Safety measures should be taken when handling this substance due to its potential health effects, including skin and eye irritation, and it is advisable to follow regulatory guidelines for its use and disposal.
Formula:C30H39O4P
InChI:InChI=1S/C30H39O4P/c1-28(2,3)22-10-16-25(17-11-22)32-35(31,33-26-18-12-23(13-19-26)29(4,5)6)34-27-20-14-24(15-21-27)30(7,8)9/h10-21H,1-9H3
InChI key:InChIKey=LORSVOJSXMHDHF-UHFFFAOYSA-N
SMILES:P(OC1=CC=C(C(C)(C)C)C=C1)(OC2=CC=C(C(C)(C)C)C=C2)(OC3=CC=C(C(C)(C)C)C=C3)=O
Synonyms:
  • 4-(1,1-Dimethylethyl)phenol phosphate (3:1)
  • NSC 2884
  • Phenol, 4-(1,1-dimethylethyl)-, 1,1′,1′′-phosphate
  • Phenol, 4-(1,1-dimethylethyl)-, phosphate (3:1)
  • Phenol, p-tert-butyl-, phosphate (3:1)
  • Tris(4-Tert-Butylphenyl) Phosphate
  • Tris(4-tert-butoxyphenyl) phosphate
  • p-tert-Butylphenol, phosphate (3:1)
  • Tris(p-tert-butylphenyl) phosphate
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