Phenol, 4,4'-[1-[4-[1-(4-hydroxyphenyl)-1-methylethyl]phenyl]ethylidene]bis-

Base Information

• Chemical Name: Phenol, 4,4'-[1-[4-[1-(4-hydroxyphenyl)-1-methylethyl]phenyl]ethylidene]bis-
• CAS No.: 110726-28-8
• Deprecated CAS: 134925-36-3,151688-33-4,503835-78-7,151688-33-4
• Molecular Formula: C29H28 O3
• Molecular Weight: 424.54
• Hs Code.: 2907299090
• European Community (EC) Number: 425-600-3,638-739-1
• DSSTox Substance ID: DTXSID3073052
• Nikkaji Number: J157.826J
• Wikidata: Q65621760
• ChEMBL ID: CHEMBL455575
• Mol file: 110726-28-8.mol

Synonyms:110726-28-8;4,4'-(1-(4-(2-(4-hydroxyphenyl)propan-2-yl)phenyl)ethane-1,1-diyl)diphenol;alpha,alpha,alpha'-Tris(4-hydroxyphenyl)-1-ethyl-4-isopropylbenzene;Phenol, 4,4'-[1-[4-[1-(4-hydroxyphenyl)-1-methylethyl]phenyl]ethylidene]bis-;4-[2-[4-[1,1-bis(4-hydroxyphenyl)ethyl]phenyl]propan-2-yl]phenol;EC 425-600-3;alpha,alpha,alpha-Tris(4-hydroxyphenyl)-1-ethyl-4-isopropylbenzene;Phenol, 4,4'-(1-(4-(1-(4-hydroxyphenyl)-1-methylethyl)phenyl)ethylidene)bis-;4,4'-(1-(4-(1-(4-Hydroxyphenyl)-1-methylethyl)phenyl)ethylidene)diphenol;4,4'-(1-{4-[1-(4-hydroxyphenyl)-1-methylethyl]phenyl}ethylidene)diphenol;4-(2-{4-[1,1-BIS(4-HYDROXYPHENYL)ETHYL]PHENYL}PROPAN-2-YL)PHENOL;4,4'-(1-{4-[2-(4-Hydroxyphenyl)propan-2-yl]phenyl}ethane-1,1-diyl)diphenol;SCHEMBL35973;triphenylmethane derivative, 6;CHEMBL455575;DTXSID3073052;BDBM29334;WXYSZTISEJBRHW-UHFFFAOYSA-;BP_08;AMY18426;MFCD00191685;4,4'-(1-(p-(4-Hydroxy-alpha,alpha-dimethylbenzyl)phenyl)ethylidene)diphenol;SB66489;4,4'-[1-[4-[1-(4-Hydroxyphenyl)-1-methylethyl]phenyl]ethylidene]bis(phenol);AS-73142;CS-0154634;FT-0754772;T1428;D81781;A894858;Q65621760;1-[1-(4-hydroxyphenyl)isopropyl]-4-[1,1-bis(4-hydroxyphenyl)ethyl]benzene;4,4'-[1-[4-[1-(4-hydroxyphenyl)-1-methylethyl]phenyl]ethylidene]bisphenol;4-[1-[4-[1,1-bis(4-hydroxyphenyl)ethyl]phenyl]-1-methyl-ethyl]phenol;4-[4-[1,1-Bis(4-hydroxyphenyl)ethyl]-alpha,alpha-dimethylbenzyl]phenol;4-[4-[1,1-Bis(4-hydroxyphenyl)ethyl]]-alpha,alpha-dimethylbenzylphenol;4,4''-(1-(4-(2-(4-Hydroxyphenyl)Propan-2-Yl)Phenyl)Ethane-1,1-Diyl)Diphenol;4-[1-(4-hydroxyphenyl)-1-[4-[2-(4-hydroxyphenyl)propan-2-yl]phenyl]ethyl]phenol

Chemical Property of Phenol, 4,4'-[1-[4-[1-(4-hydroxyphenyl)-1-methylethyl]phenyl]ethylidene]bis-

Chemical Property:

• Vapor Pressure: 4.05E-16mmHg at 25°C
• Melting Point: 225°C
• Boiling Point: 623.1°Cat760mmHg
• PKA: 10.22±0.10(Predicted)
• Flash Point: 272.6°C
• PSA: 60.69000
• Density: 1.186g/cm³
• LogP: 6.48360
• Storage Temp.: Sealed in dry,Room Temperature
• Solubility.: soluble in Methanol
• XLogP3: 6.9
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 424.20384475
• Heavy Atom Count: 32
• Complexity: 547

Purity/Quality:

99.9% ^*data from raw suppliers

α,α,α''-Tris(4-hydroxyphenyl)-1-ethyl-4-isopropylbenzene ^*data from reagent suppliers

Safty Information:

• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C1=CC=C(C=C1)C(C)(C2=CC=C(C=C2)O)C3=CC=C(C=C3)O)C4=CC=C(C=C4)O
• Uses: α,α,α''-Tris(4-hydroxyphenyl)-1-ethyl-4-isopropylbenzene is a useful reactant in the synthesis of single-?walled carbon nanotubes (SWNTs) through irradation with an IR laser.

Technology Process of Phenol, 4,4'-[1-[4-[1-(4-hydroxyphenyl)-1-methylethyl]phenyl]ethylidene]bis-

There total 12 articles about Phenol, 4,4'-[1-[4-[1-(4-hydroxyphenyl)-1-methylethyl]phenyl]ethylidene]bis- 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: 92.6%

1,1-bis(4-hydroxyphenyl)-1-[4'-(α-bromoisopropylphenyl)]ethane + phenol (108-95-2,27073-41-2) → 4,4'-(1-(4 (2-(4-hydroxyphenyl)propane-2-yl)phenyl)ethane-1,1-diyl)bis(phenol) (110726-28-8)

Guidance literature:

With zinc(II) chloride; In dichloromethane; at 40 ℃; for 3h;

Reference yield: 90.2%

1,1-bis(4-hydroxyphenyl)-1-[4'-(α-chloroisopropylphenyl)]ethane + phenol (108-95-2,27073-41-2) → 4,4'-(1-(4 (2-(4-hydroxyphenyl)propane-2-yl)phenyl)ethane-1,1-diyl)bis(phenol) (110726-28-8)

Guidance literature:

With zinc(II) chloride; In dichloromethane; for 3h; Reflux;

Reference yield:

1-(4-(2-hydroxypropan-2-yl)phenyl)ethan-1-one (54549-72-3) + phenol (108-95-2,27073-41-2) → 4,4'-(1-(4 (2-(4-hydroxyphenyl)propane-2-yl)phenyl)ethane-1,1-diyl)bis(phenol) (110726-28-8)

Guidance literature:

1-(4-(2-hydroxypropan-2-yl)phenyl)ethan-1-one; phenol; With 1-dodecylthiol; In methanol; at 60 ℃; for 1h;

With hydrogenchloride; In methanol; at 60 ℃; for 12h;

upstream raw materials:

p-cumylphenol

4-(1-methyl-1-phenylethyl)phenyl acetate

1-acetyl-4-{1-methyl-1-(4-acetyloxyphenyl)ethyl}benzene

1-acetyl-4-{1-methyl-1-(4-hydroxyphenyl)ethyl}benzene

Downstream raw materials:

C₄₄H₅₂O₉

C₃₅H₃₁O₄P

1-[1,1-bis(4-methoxyphenyl)ethyl]-4-[2-(4-methoxyphenyl)propan-2-yl]benzene

4-[1-(3-bromo-4-hydroxyphenyl)-1-[4-[2-(3-bromo-4-hydroxyphenyl)propan-2-yl]phenyl]ethyl]-2-bromophenol

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