alpha,alpha'-Bis(4-hydroxyphenyl)-1,4-diisopropylbenzene

Base Information

• Chemical Name: alpha,alpha'-Bis(4-hydroxyphenyl)-1,4-diisopropylbenzene
• CAS No.: 2167-51-3
• Molecular Formula: C24H26 O2
• Molecular Weight: 346.469
• Hs Code.: 29072990
• European Community (EC) Number: 606-820-0
• DSSTox Substance ID: DTXSID0058693
• Nikkaji Number: J93.704E
• Wikidata: Q65643375
• Metabolomics Workbench ID: 87158
• ChEMBL ID: CHEMBL452151
• Mol file: 2167-51-3.mol

Synonyms:Bisphenol P;2167-51-3;alpha,alpha'-Bis(4-hydroxyphenyl)-1,4-diisopropylbenzene;4-[2-[4-[2-(4-hydroxyphenyl)propan-2-yl]phenyl]propan-2-yl]phenol;4,4'-(1,4-Phenylenediisopropylidene)bisphenol;1,4-Bis(4-hydroxy-a,a-dimethylbenzyl)benzene;4-[1-[4-[1-(4-hydroxyphenyl)-1-methyl-ethyl]phenyl]-1-methyl-ethyl]phenol;alpha,alpha-Bis(4-hydroxyphenyl)-1,4-diisopropylbenzene;4-(2-{4-[2-(4-hydroxyphenyl)propan-2-yl]phenyl}propan-2-yl)phenol;diphenol derivative, 10;4,4'-((p-Phenylene)diisopropylidene)diphenol;SCHEMBL27996;4,4'-(1,4-Phenylenebis(propane-2,2-diyl))diphenol;CHEMBL452151;DTXSID0058693;BDBM29338;GIXXQTYGFOHYPT-UHFFFAOYSA-;Bisphenol??P, analytical standard;CHEBI:165197;MFCD00191315;AKOS015915934;Bisphenol P 100 microg/mL in Methanol;AS-68061;B1563;CS-0204533;FT-0622082;D95340;1,4-Bis[2-(4-hydroxyphenyl)-2-propyl]benzene;4,4'-(1,4-Phenylenediisopropylidene)-bisphenol;A847498;J-700239;4,4'-(1,4-Phenylenediisopropylidene)bisphenol, 99%;4,4'-[1,4-Phenylenedi(propane-2,2-diyl)]diphenol;Q65643375;4,4'-[1,4-phenylenebis(1-methylethylidene)]bis-phenol;alpha, alpha'-bis-(4-hydroxyphenyl)-p-diisopropylbenzene;alpha,alpha'-bis-(4-hydroxyphenyl)-p-diisopropylbenzene;4,4'-[1,4-phenylenebis(1-methylethylidene)]bis[phenol];Phenol, 4,4'-[1,4-phenylenebis(1-methylethylidene)]bis-;4,4'-(2,2'-(1,4-phenylene)bis(propane-2,2-diyl))diphenol;4-(1-(4-[1-(4-Hydroxyphenyl)-1-methylethyl]phenyl)-1-methylethyl)phenol #;alpha,alpha,alpha',alpha'-tetramethyl-alpha,alpha'-bis(4-hydroxyphenyl)-p-xylene

Chemical Property of alpha,alpha'-Bis(4-hydroxyphenyl)-1,4-diisopropylbenzene

Chemical Property:

• Melting Point: 193-195 °C(lit.)
• Boiling Point: 246 °C(Press: 0.1 Torr)
• PKA: 10.31±0.10(Predicted)
• Flash Point: 230.1oC
• PSA: 40.46000
• Density: 1.107±0.06 g/cm3(Predicted)
• LogP: 5.74960
• Solubility.: very faint turbidity in Methanol
• XLogP3: 6.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 346.193280068
• Heavy Atom Count: 26
• Complexity: 389

Purity/Quality:

98%,99%, ^*data from raw suppliers

alpha,alpha'-Bis(4-hydroxyphenyl)-1,4-diisopropylbenzene >98.0%(GC) ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 36
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

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

Technology Process of alpha,alpha'-Bis(4-hydroxyphenyl)-1,4-diisopropylbenzene

There total 2 articles about alpha,alpha'-Bis(4-hydroxyphenyl)-1,4-diisopropylbenzene 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: 65.0%

α,α,α',α'-tetramethyl-1,4-benzenedimethanol (2948-46-1) + phenol (108-95-2,27073-41-2) → 4,4'-(1,4-phenylene-diisopropylidene)-bisphenol (2167-51-3)

Guidance literature:

With hydrogenchloride; at 80 ℃; for 3.5h;

DOI:10.1002/poc.981

Reference yield:

→ 4,4'-(1,4-phenylene-diisopropylidene)-bisphenol (2167-51-3)

Guidance literature:

p-(HOCMe2)C6H4, Phenol;

Reference yield: 99.0%

2-bromo-pyridine (109-04-6) + 4,4'-(1,4-phenylene-diisopropylidene)-bisphenol (2167-51-3) → C34H32N2O2 (1020725-47-6)

Guidance literature:

4,4'-(1,4-phenylene-diisopropylidene)-bisphenol; With potassium carbonate; In sulfolane; toluene; at 20 ℃; for 0.75h;

2-bromo-pyridine; at 80 ℃; for 48h; Further stages.;

DOI:10.1016/j.tet.2008.01.092

upstream raw materials:

α,α,α',α'-tetramethyl-1,4-benzenedimethanol

phenol

Downstream raw materials:

α,α'-bis[(5-bromopentoxy)phenyl]-1,4-di(isopropyl)benzene

Refernces

• 1、 -. "Salicylic acid derivatives". . . Retrieved 2008/06/13.
• 2、 -. "Method for preparing aromatic bischloroformate compositions". . . Retrieved 2008/06/13.