Tris(4-isopropylphenyl) phosphate

Base Information

• Chemical Name: Tris(4-isopropylphenyl) phosphate
• CAS No.: 2502-15-0
• Molecular Formula: C27H33 O4 P
• Molecular Weight: 452.53
• European Community (EC) Number: 248-147-1,219-703-0
• UN Number: 3077
• UNII: Y3H2FDX0NW
• DSSTox Substance ID: DTXSID80858783
• Nikkaji Number: J180.509F
• Wikidata: Q27294219
• ChEMBL ID: CHEMBL458602

Synonyms:Tris(4-isopropylphenyl) phosphate;26967-76-0;2502-15-0;tris(4-propan-2-ylphenyl) phosphate;Tris(isopropylphenyl) phosphate;Tris(p-isopropylphenyl)phosphate;Phenol,(1-methylethyl)-, phosphate (3:1);Tris(p-cumenyl)phosphate;UNII-Y3H2FDX0NW;Y3H2FDX0NW;Phenol, 4-(1-methylethyl)-, phosphate (3:1);Tri(4-isopropylphenyl)phosphate;DTXSID80858783;EINECS 219-703-0;Tris[4-(2-methylethyl)phenyl] phosphate;DSSTox_CID_8880;DSSTox_RID_78659;DSSTox_GSID_28880;CAS-68937-41-7;C27H33O4P;Tri(4-isopropylphenyl) phosphate;Isopropylphenylphosphat;TRICUMOL PHOSPHATE;SCHEMBL36617;Tris(isopropylphenyl)phosphates;CHEMBL458602;Tris(4-isopropylphenyl)Phosphate;2-(4-methylbenzoyl)butanoic acid;Tox21_202764;Tox21_202765;Tox21_202766;ETHYL(4-METHYLBENZOYL)ACETATE;NCGC00260311-01;NCGC00260312-01;NCGC00260313-01;TRIS(P-ISOPROPYLPHENYL) PHOSPHATE;A5347;P-CUMENYL PHOSPHATE ((C9H11O)3PO);Phosphoric acid tris(4-isopropylphenyl) ester;PHENOL, P-ISOPROPYL-, PHOSPHATE (3:1);W-104649;W-107139;Phenol, (1-methylethyl)-, phosphate (3:1) (9CI);Q27294219

Chemical Property of Tris(4-isopropylphenyl) phosphate

Chemical Property:

• Boiling Point: 489.7°Cat760mmHg
• Flash Point: 263.1°C
• Density: 1.108g/cm³
• XLogP3: 7.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 9
• Exact Mass: 452.21164653
• Heavy Atom Count: 32
• Complexity: 500
• Transport DOT Label: Class 9

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)C1=CC=C(C=C1)OP(=O)(OC2=CC=C(C=C2)C(C)C)OC3=CC=C(C=C3)C(C)C

Technology Process of Tris(4-isopropylphenyl) phosphate

There total 5 articles about Tris(4-isopropylphenyl) phosphate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 87.0%

4-Isopropylphenol (99-89-8) → tris(4-isopropylphenyl) phosphate (2502-15-0)

Guidance literature:

4-Isopropylphenol; With potassium phosphate; diphenyl diselenide; phosphorus; In dimethyl sulfoxide; toluene; at 60 ℃; for 4h; Inert atmosphere;

With dihydrogen peroxide; In dimethyl sulfoxide; toluene; at 20 ℃; for 0.5h; Inert atmosphere;

Reference yield:

C27H33O3P (2502-16-1) → tris(4-isopropylphenyl) phosphate (2502-15-0)

Guidance literature:

With dihydrogen peroxide; In dimethyl sulfoxide; toluene; at 20 ℃; for 0.5h; Schlenk technique;

DOI:10.1021/acs.orglett.1c01695

Reference yield:

4-Isopropylphenol (99-89-8) → tris(4-isopropylphenyl) phosphate (2502-15-0)

Guidance literature:

With triethylamine; In toluene; for 5h;

DOI:10.1007/s002449900466

upstream raw materials:

4-Isopropylphenol

bis(4-isopropylphenyl)phosphoryl chloride

trichlorophosphate

C₂₇H₃₃O₃P

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