[(E)-3-(2,3,4,5-tetrachlorocyclopenta-2,4-dien-1-ylidene)prop-1-enyl]benzene

Base Information

• Chemical Name: [(E)-3-(2,3,4,5-tetrachlorocyclopenta-2,4-dien-1-ylidene)prop-1-enyl]benzene
• CAS No.: 61355-19-9
• Molecular Formula: C₁₄H₈Cl₄
• Molecular Weight: 318.03
• Hs Code.: 2903999090
• NSC Number: 26113
• ChEMBL ID: CHEMBL1460639
• Mol file: 61355-19-9.mol

Synonyms:NSC26113;MLS000738052;61355-19-9;CHEMBL1460639;HMS2752I13;NSC-26113;SMR000393725

Chemical Property of [(E)-3-(2,3,4,5-tetrachlorocyclopenta-2,4-dien-1-ylidene)prop-1-enyl]benzene

Chemical Property:

• Vapor Pressure: 0.000198mmHg at 25°C
• Boiling Point: 338°C at 760 mmHg
• Flash Point: 150.3°C
• PSA: 0.00000
• Density: 1.43g/cm³
• LogP: 6.01820
• XLogP3: 5.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 2
• Exact Mass: 317.935061
• Heavy Atom Count: 18
• Complexity: 422

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C=CC=C2C(=C(C(=C2Cl)Cl)Cl)Cl
• Isomeric SMILES: C1=CC=C(C=C1)/C=C/C=C2C(=C(C(=C2Cl)Cl)Cl)Cl

Technology Process of [(E)-3-(2,3,4,5-tetrachlorocyclopenta-2,4-dien-1-ylidene)prop-1-enyl]benzene

There total 4 articles about [(E)-3-(2,3,4,5-tetrachlorocyclopenta-2,4-dien-1-ylidene)prop-1-enyl]benzene 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:

hexachlorocyclopentadiene (77-47-4) → 1,2,3,4-tetrachloro-5-trans-cinnamylidene-cyclopentadiene (61355-19-9)

Guidance literature:

Multi-step reaction with 2 steps

1: petroleum ether; zinc; aqueous hydrochloric acid

2: ethanol

With hydrogenchloride; ethanol; Petroleum ether; zinc;

DOI:10.1021/ja01606a027

Reference yield:

(E)-3-phenylpropenal (14371-10-9) + 1,2,3,4-tetrachloro-cyclopenta-1,3-diene (695-77-2) → 1,2,3,4-tetrachloro-5-trans-cinnamylidene-cyclopentadiene (61355-19-9)

Guidance literature:

With ethanol;

DOI:10.1021/ja01606a027

Reference yield:

N-<3-Phenyl-propenyliden>-propylamin (34117-40-3,88304-21-6) + 1,2,3,4-tetrachloro-cyclopenta-1,3-diene (695-77-2) → [(E)-3-(2,3,4,5-Tetrachloro-cyclopenta-2,4-dienylidene)-propenyl]-benzene (61355-19-9)

Guidance literature:

In toluene;

upstream raw materials:

N-<3-Phenyl-propenyliden>-propylamin

1,2,3,4-tetrachloro-cyclopenta-1,3-diene

(E)-3-phenylpropenal

hexachlorocyclopentadiene

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