Bisphenol C

Base Information

• Chemical Name: Bisphenol C
• CAS No.: 14868-03-2
• Molecular Formula: C14H10 Cl2 O2
• Molecular Weight: 281.138
• Hs Code.: 2908199090
• European Community (EC) Number: 238-940-0
• UNII: U4668GRX7T
• DSSTox Substance ID: DTXSID5022485
• Nikkaji Number: J227.221K
• Wikidata: Q27115763
• Metabolomics Workbench ID: 67957
• ChEMBL ID: CHEMBL592305
• Mol file: 14868-03-2.mol

Synonyms:4-(2,2-dichloro-1-(4-hydroxyphenyl)ethenyl)phenol;bisphenol C

Chemical Property of Bisphenol C

Chemical Property:

• Vapor Pressure: 3.87E-07mmHg at 25°C
• Melting Point: 213-217 °C(lit.)
• Boiling Point: 405 °C at 760 mmHg
• PKA: 9.86±0.15(Predicted)
• Flash Point: 198.7 °C
• PSA: 40.46000
• Density: 1.407 g/cm³
• LogP: 4.29230
• Storage Temp.: Hygroscopic, Refrigerator, under inert atmosphere
• Solubility.: DMSO (Slightly), Ethyl Acetate (Slightly)
• XLogP3: 5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 280.0057849
• Heavy Atom Count: 18
• Complexity: 273

Purity/Quality:

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

4-[2,2-Dichloro-1-(4-hydroxyphenyl)ethenyl]phenol ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1C(=C(Cl)Cl)C2=CC=C(C=C2)O)O
• Uses: Bisphenol C is a congener of Bisphenol A; a well known endocrine-disrupting chemical with estrogenic activity.

Technology Process of Bisphenol C

There total 7 articles about Bisphenol C 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: 85.8%

1,1-dichloro-2,2-bis(p-methoxyphenyl)ethylene (2132-70-9) → 1,1-dichloro-2,2-bis(4-hydroxyphenyl)ethylene (14868-03-2)

Guidance literature:

With pyridine hydrochloride; at 210 ℃; for 0.333333h;

Reference yield: 81.1%

Methoxychlor (72-43-5,105367-23-5) → 1,1-dichloro-2,2-bis(4-hydroxyphenyl)ethylene (14868-03-2)

Guidance literature:

With pyridine hydrochloride; at 210 ℃; for 0.333333h;

Reference yield:

2,2-bis(p-hydroxyphenyl)-1,1,1-trichloroethane (2971-36-0) → 1,1-dichloro-2,2-bis(4-hydroxyphenyl)ethylene (14868-03-2)

Guidance literature:

With potassium hydroxide;

DOI:10.1021/jo01094a030

upstream raw materials:

2,2-bis(p-hydroxyphenyl)-1,1,1-trichloroethane

1,1-dichloro-2,2-bis(p-methoxyphenyl)ethylene

Methoxychlor

o,p'-DDE

Downstream raw materials:

1,1-bis-(4-acetoxy-phenyl)-2,2-dichloro-ethene

1,1-dichloro-2,2-bis-(4-propionyloxy-phenyl)-ethene

1,1-dichloro-2,2-bis(4-(2-(vinyloxy)ethoxy)phenyl)ethylene

1,1-dichloro-2,2-(4-cyanatophenyl)ethylidene

Refernces

• 1、 -. "Cyanate esters having flame resistant properties". . . Retrieved 2008/06/13.
• 2、 -. "Bischoloroformate preparation method with phosgene removal and monochloroformate conversion". . . Retrieved 2008/06/13.