1,4-Naphthalenedipropionic acid, 1,4-endoperoxide

Base Information

• Chemical Name: 1,4-Naphthalenedipropionic acid, 1,4-endoperoxide
• CAS No.: 97860-59-8
• Molecular Formula: C₁₆H₁₄O₆*2Na
• Molecular Weight: 348.263
• DSSTox Substance ID: DTXSID50913616
• Nikkaji Number: J473.738E
• Mol file: 97860-59-8.mol

Synonyms:3,3'-(1,4-naphthylidene)dipropionate endoperoxide;3,3'-(1,4-naphthylidene)dipropionate endoperoxide, disodium salt;3,3'-(1,4-naphthylidene)diproprionate;napthalene-1,4-dipropionate endoperoxide;NDPO2

Chemical Property of 1,4-Naphthalenedipropionic acid, 1,4-endoperoxide

Chemical Property:

• Vapor Pressure: 1.1E-11mmHg at 25°C
• Boiling Point: 521.1°Cat760mmHg
• Flash Point: 195.6°C
• PSA: 93.06000
• Density: 1.414g/cm³
• LogP: 2.56340
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 6
• Exact Mass: 304.09468823
• Heavy Atom Count: 22
• Complexity: 457

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C3(C=CC2(OO3)CCC(=O)O)CCC(=O)O

Technology Process of 1,4-Naphthalenedipropionic acid, 1,4-endoperoxide

There total 1 articles about 1,4-Naphthalenedipropionic acid, 1,4-endoperoxide 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: 80.0%

Disodium 3,3'-(1,4-Naphthylidene) dipropionate (97860-58-7) → disodium 3,3'-(naphthalene-1,4-diyl)dipropionate endoperoxide (97860-59-8)

Guidance literature:

With oxygen; In methanol; water; at 5 ℃; for 3h; Irradiation;

DOI:10.1021/ja00307a002

Reference yield:

disodium 3,3'-(naphthalene-1,4-diyl)dipropionate endoperoxide (97860-59-8) → Disodium 3,3'-(1,4-Naphthylidene) dipropionate (97860-58-7)

Guidance literature:

In water; at 37 ℃; thermal decomposition; pH = 7.4 ; addition of DABCO;

DOI:10.1021/ja00190a027

upstream raw materials:

Disodium 3,3'-(1,4-Naphthylidene) dipropionate

Downstream raw materials:

Disodium 3,3'-(1,4-Naphthylidene) dipropionate

Refernces

• 1、 Aubry, Jean-Marie,Mandard-Cazin, Bernadette,Rougee, Michel,Bensasson, René V.. "Kinetic studies of singlet oxygen [4 + 2]-cycloadditions with cyclic 1,3-dienes in 28 solvents". . p. 9159 - 9164. Retrieved 1995.