Phenol, 4,4'-(3,3,5-trimethylcyclohexylidene)bis-

Base Information

• Chemical Name: Phenol, 4,4'-(3,3,5-trimethylcyclohexylidene)bis-
• CAS No.: 129188-99-4
• Deprecated CAS: 324027-35-2
• Molecular Formula: C21H26 O2
• Molecular Weight: 310.436
• European Community (EC) Number: 404-140-7,603-320-4
• DSSTox Substance ID: DTXSID50881048
• Nikkaji Number: J327.379B
• Wikidata: Q65619821
• Mol file: 129188-99-4.mol

Synonyms:129188-99-4;Bisphenol TMC;4,4'-(3,3,5-trimethylcyclohexane-1,1-diyl)diphenol;Phenol, 4,4'-(3,3,5-trimethylcyclohexylidene)bis-;4-[1-(4-hydroxyphenyl)-3,3,5-trimethylcyclohexyl]phenol;1,1-bis-(4-hydroxyphenyl)-3,3,5-trimethylcyclohexane;BISP-TMC;BPTMC;Bisphenol I;Hydro Isophorone Bisphenol;4,4'-(3,3,5-Trimethylcyclohexylidene)diphenol;SCHEMBL18187;DTXSID50881048;UMPGNGRIGSEMTC-UHFFFAOYSA-N;BDBM176759;AKOS025287093;AS-68282;US9688816, J;Bisphenol TMC 100 microg/mL in Methanol;FT-0663376;CAS# 129188-99-4;E79165;4,4'-(3,3,5-Trimethylcyclohexilidene)bisphenol;4,4'-(3,3,5-trimethylcyclohexylidene)bisphenol;A888889;Phenol,4,4-(3,3,5-trimethylcyclohexylidene)bis-;Q65619821;1,1-bis-(4-hydroxyphenyl)-3,3,5-trimethyl-cyclohexane;3,3,5-Trimethyl-1,1-bis-(4-hydroxyphenyl)-cyclohexane;2~3~,2~3~,2~5~-Trimethyl-2~3~,2~4~,2~5~,2~6~-tetrahydro-2~2~H-[1~1~,2~1~:2~1~,3~1~-terphenyl]-1~4~,3~4~-diol

Chemical Property of Phenol, 4,4'-(3,3,5-trimethylcyclohexylidene)bis-

Chemical Property:

• Vapor Pressure: 9.59E-09mmHg at 25°C
• Melting Point: 204-207°C
• Boiling Point: 450.8°C at 760 mmHg
• PKA: 9.91±0.30(Predicted)
• Flash Point: 202.8°C
• PSA: 40.46000
• Density: 1.075g/cm³
• LogP: 5.23010
• Storage Temp.: Room Temperature
• Solubility.: Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly)
• XLogP3: 6.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 310.193280068
• Heavy Atom Count: 23
• Complexity: 365

Purity/Quality:

98%, ^*data from raw suppliers

Bisphenol TMC ^*data from reagent suppliers

Safty Information:

• Pictogram(s): 9785841
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CC(CC(C1)(C2=CC=C(C=C2)O)C3=CC=C(C=C3)O)(C)C
• Uses: Bisphenol TMC(1,1-Bis(4-hydroxyphenyl)-3,3,5-trimethylcyclohexane) is a bisphenol derivative used in the preparation of polycarbonate, polyester and epoxy resins.

Technology Process of Phenol, 4,4'-(3,3,5-trimethylcyclohexylidene)bis-

There total 12 articles about Phenol, 4,4'-(3,3,5-trimethylcyclohexylidene)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: 96.8%

primary crystallization filtrate + secondary filtrate residue + dihydroisophorone (873-94-9) + phenol (108-95-2,27073-41-2) → 1,1-bis-(4-hydroxyphenyl)-3,3,5-trimethyl cyclohexane (129188-99-4)

Guidance literature:

secondary filtrate residue; phenol; With phosphoric acid; water;

With hydrogenchloride; at 20 ℃;

primary crystallization filtrate; dihydroisophorone; With sodium thiomethoxide; at 20 - 40 ℃; for 9h;

Reference yield: 92.9%

dihydroisophorone (873-94-9) + phenol (108-95-2,27073-41-2) → 1,1-bis-(4-hydroxyphenyl)-3,3,5-trimethyl cyclohexane (129188-99-4)

Guidance literature:

dihydroisophorone; phenol; With phosphoric acid; water; hydrogenchloride; In water; at 20 ℃; Heating / reflux;

dihydroisophorone; phenol; With sodium thiomethoxide; at 20 - 40 ℃; for 9h;

Reference yield: 92.2%

secondary filtrate residue + dihydroisophorone (873-94-9) + phenol (108-95-2,27073-41-2) → 1,1-bis-(4-hydroxyphenyl)-3,3,5-trimethyl cyclohexane (129188-99-4)

Guidance literature:

secondary filtrate residue; phenol; With water; Heating / reflux;

With hydrogenchloride; at 20 ℃;

dihydroisophorone; phenol; With sodium thiomethoxide; In water; at 20 - 40 ℃; for 9.5h;

upstream raw materials:

dihydroisophorone

phenol

Octanethiol

1-dodecylthiol

Downstream raw materials:

1,1-bis(3-nitro-4-hydroxyphenyl)-3,3,5-trimethylcyclohexane

Refernces

• 1、 -. "1, 1-bis (4-hydroxyphenyl)-3, 3, 5-trimethylcyclohexane manufacturing method". Paragraph 0030-0041. . Retrieved 2018/11/22.
• 2、 -. "Process for production of 1,1-bis(4-hydroxyphenyl)-3,3,5-trimethylcyclohexane". Page column 5-6. . Retrieved 2010/02/05.