Phenol, 4,4'-(1-methylethylidene)bis[2,6-bis(1,1-dimethylethyl)-

Base Information

• Chemical Name: Phenol, 4,4'-(1-methylethylidene)bis[2,6-bis(1,1-dimethylethyl)-
• CAS No.: 13676-82-9
• Deprecated CAS: 25619-72-1
• Molecular Formula: C31H48 O2
• Molecular Weight: 452.721
• Hs Code.: 2907299090
• European Community (EC) Number: 237-165-5
• DSSTox Substance ID: DTXSID4065575
• Nikkaji Number: J277.980C
• Wikidata: Q65621762
• Mol file: 13676-82-9.mol

Synonyms:13676-82-9;Phenol, 4,4'-(1-methylethylidene)bis[2,6-bis(1,1-dimethylethyl)-;EINECS 237-165-5;4,4'-Isopropylidenebis(2,6-di-tert-butylphenol);2,6-ditert-butyl-4-[2-(3,5-ditert-butyl-4-hydroxyphenyl)propan-2-yl]phenol;4,4'-isopropylidenebis[2,6-di-tert-butylphenol];4,4'-(1-Methylethylidene)bis(2,6-di-tert-butylphenol);Phenol, 4,4'-(1-methylethylidene)bis(2,6-bis(1,1-dimethylethyl)-;Phenol, 4,4'-(1-methylethylidene) bis[2,6-bis(1,1-dimethylethyl)-;SCHEMBL39689;DTXSID4065575;BP_26;4,4/'-Isopropylidenebis(2,6-di-tert-butylphenol);Q65621762;4,4'-(Propane-2,2-diyl)bis(2,6-di-tert-butylphenol)

Chemical Property of Phenol, 4,4'-(1-methylethylidene)bis[2,6-bis(1,1-dimethylethyl)-

Chemical Property:

• Boiling Point: 456°Cat760mmHg
• Flash Point: 169.5°C
• PSA: 40.46000
• Density: 0.97g/cm³
• LogP: 8.61370
• XLogP3: 10.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 6
• Exact Mass: 452.365430770
• Heavy Atom Count: 33
• Complexity: 544

Purity/Quality:

98%Min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(C)(C)C2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C

Technology Process of Phenol, 4,4'-(1-methylethylidene)bis[2,6-bis(1,1-dimethylethyl)-

There total 3 articles about Phenol, 4,4'-(1-methylethylidene)bis[2,6-bis(1,1-dimethylethyl)- 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:

BPA (80-05-7) + isobutene (115-11-7,15220-85-6) → 2,2-bis-(3,5-di-tert-butyl-4-hydroxyphenyl)-propane (13676-82-9,25619-72-1)

Guidance literature:

With aluminium(III) phenoxide; In toluene; at 135 - 145 ℃; for 5h;

Reference yield:

2,6-di-tert-butylphenol (128-39-2) + 6-Hydroxy-1-methyl-3-isopropenyl-benzol (26866-87-5) → 2,2-bis-(3,5-di-tert-butyl-4-hydroxyphenyl)-propane (13676-82-9,25619-72-1) + 2-Methyl-2',6'-di-tert.-butyl-4,4'-isopropyliden-bisphenol (19546-23-7)

Guidance literature:

With hydrogenchloride; In toluene;

Reference yield:

→ 2,2-bis-(3,5-di-tert-butyl-4-hydroxyphenyl)-propane (13676-82-9,25619-72-1)

Guidance literature:

2,2-Bis-(4-hydroxyphenyl)-propan, t-BuOH (ohne Solv., Kat. HCl/ZnCl2, 3h, 80-100grad);

upstream raw materials:

2,6-di-tert-butylphenol

6-Hydroxy-1-methyl-3-isopropenyl-benzol

BPA

isobutene

Downstream raw materials:

2,6-di-t-butyl-4-i-propenylphenol