2,6-Dichloro-4-[1-(3,5-dichloro-4-hydroxyphenyl)cyclohexyl]phenol

Base Information

• Chemical Name: 2,6-Dichloro-4-[1-(3,5-dichloro-4-hydroxyphenyl)cyclohexyl]phenol
• CAS No.: 13168-35-9
• Molecular Formula: C18H16 Cl4 O2
• Molecular Weight: 406.13
• Hs Code.: 2908199090
• NSC Number: 15450
• DSSTox Substance ID: DTXSID70280099
• Nikkaji Number: J555.817D
• Wikidata: Q82013176
• Mol file: 13168-35-9.mol

Synonyms:13168-35-9;2,6-dichloro-4-[1-(3,5-dichloro-4-hydroxyphenyl)cyclohexyl]phenol;1,1-bis(3,5-dichloro-4-hydroxyphenyl)cyclohexane;2,6-DICHLORO-4-[1-(3,5-DICHLORO-4-HYDROXY-PHENYL)CYCLOHEXYL]PHENOL;NSC15450;SCHEMBL69429;DTXSID70280099;NSC 15450;NSC-15450;1~3~,1~5~,3~3~,3~5~-Tetrachloro-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 2,6-Dichloro-4-[1-(3,5-dichloro-4-hydroxyphenyl)cyclohexyl]phenol

Chemical Property:

• Vapor Pressure: 2.35E-10mmHg at 25°C
• Boiling Point: 493.3°C at 760 mmHg
• Flash Point: 252.1°C
• PSA: 40.46000
• Density: 1.461g/cm³
• LogP: 6.96160
• XLogP3: 7.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 405.987490
• Heavy Atom Count: 24
• Complexity: 373

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC(CC1)(C2=CC(=C(C(=C2)Cl)O)Cl)C3=CC(=C(C(=C3)Cl)O)Cl

Technology Process of 2,6-Dichloro-4-[1-(3,5-dichloro-4-hydroxyphenyl)cyclohexyl]phenol

There total 4 articles about 2,6-Dichloro-4-[1-(3,5-dichloro-4-hydroxyphenyl)cyclohexyl]phenol 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:

1,1-bis(p-hydroxyphenyl)cyclohexane (843-55-0) → 1,1'-bis(3,5-dichloro-4-hydroxyphenyl)cyclohexane (13168-35-9)

Guidance literature:

With chlorine; acetic acid;

Reference yield:

cyclohexanone (108-94-1,11119-77-0,9003-41-2,9075-99-4) → 1,1'-bis(3,5-dichloro-4-hydroxyphenyl)cyclohexane (13168-35-9)

Guidance literature:

Multi-step reaction with 2 steps

1: hydrogenchloride; acetic acid / 3 h / 55 - 60 °C

2: sodium sulfide; thionyl chloride / tetrachloromethane / 4 h / 55 - 70 °C

With hydrogenchloride; sodium sulfide; thionyl chloride; acetic acid; In tetrachloromethane;

Reference yield:

phenol (108-95-2,27073-41-2) → 1,1'-bis(3,5-dichloro-4-hydroxyphenyl)cyclohexane (13168-35-9)

Guidance literature:

Multi-step reaction with 2 steps

1: hydrogenchloride; acetic acid / 3 h / 55 - 60 °C

2: sodium sulfide; thionyl chloride / tetrachloromethane / 4 h / 55 - 70 °C

With hydrogenchloride; sodium sulfide; thionyl chloride; acetic acid; In tetrachloromethane;

upstream raw materials:

1,1-bis(p-hydroxyphenyl)cyclohexane

cyclohexanone

phenol