Indan-1,2,3-trione

Base Information

• Chemical Name: Indan-1,2,3-trione
• CAS No.: 938-24-9
• Molecular Formula: C9H4 O3
• Molecular Weight: 160.129
• European Community (EC) Number: 213-340-1
• NSC Number: 8970
• DSSTox Substance ID: DTXSID40239655
• Nikkaji Number: J112.994E
• Wikipedia: Indane-1,2,3-trione
• Wikidata: Q83122058
• Mol file: 938-24-9.mol

Synonyms:1H-Indene-1,2,3-trione;Indan-1,2,3-trione;Indantrione;938-24-9;indene-1,2,3-trione;1,2,3-Indantrione;indane-1,2,3-trione;NSC 8970;EINECS 213-340-1;AI3-52687;Triketoindan;1,3-Indantrione;Indan-1,3-trione;2,3-dihydro-1H-indene-1,2,3-trione;1H-Indene-1,3-trione;1,2,3-Triketohydrindene;SCHEMBL17987;C9H4O3;DTXSID40239655;NSC8970;C9-H4-O3;NSC-8970;STL199169;AKOS006228122;CS-0358177

Chemical Property of Indan-1,2,3-trione

Chemical Property:

• Melting Point: 255 °C
• Boiling Point: 338.4±25.0 °C(Predicted)
• PSA: 51.21000
• Density: 1.482±0.06 g/cm3(Predicted)
• LogP: -0.20400
• XLogP3: 0.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 160.016043985
• Heavy Atom Count: 12
• Complexity: 241

Purity/Quality:

96% 1H NMR ^*data from raw suppliers

1H-Indene-1,2,3-trione 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C(=O)C(=O)C2=O

Technology Process of Indan-1,2,3-trione

There total 25 articles about Indan-1,2,3-trione 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: 100.0%

2-diazo-indan-1,3-dione (1807-49-4) → indantrione (938-24-9)

Guidance literature:

With 3,3-dimethyldioxirane; In acetone; for 26h; Ambient temperature;

DOI:10.1080/00397919408012648

Reference yield: 99.0%

indan-1,2,3-trione hydrate (485-47-2) → indantrione (938-24-9)

Guidance literature:

With pyridine; chloro-trimethyl-silane; In tetrachloromethane; for 3h; Ambient temperature;

Reference yield: 93.0%

inden-1-one (83-33-0) → indantrione (938-24-9)

Guidance literature:

With selenium(IV) oxide; In 1,4-dioxane; at 90 ℃;

DOI:10.1002/jccs.202100438

upstream raw materials:

1H-indene-1,3(2H)-dione

1H-indene-1,2,3-trione 2-oxime

C₁₉H₁₉N₃O₂

indan-1,2,3-trione hydrate

Downstream raw materials:

2-hydroxy-3-phenyl-1,4-naphthoquinone

Triketoindan-aethylketal

N'-[2,3-Dioxo-indan-(1Z)-ylidene]-hydrazinecarbodithioic acid benzyl ester

N'-[3-(Benzylsulfanylthiocarbonyl-hydrazono)-2-oxo-indan-(1Z)-ylidene]-hydrazinecarbodithioic acid benzyl ester

Refernces

• 1、 Ramazani, Ali,Ahmadi, Ebrahim,Noshiranzadeh, Nader. "One-step stereoselective synthesis of dialkyl 1,1-diacetyl-8a-hydroxy-8- oxo-1,2,8,8a-tetrahydrocyclopenta[a]indene-2,3-dicarboxylates from the reaction of dialkyl 2-(1-acetyl-2-oxopropyl)-3-(tributylphosphoranylidene) succinates with indene-1,2,3-trione". . p. 2285 - 2290. Retrieved 2005.
• 2、 Reiter, Richard C.,Stevenson, Gerald R.,Wang, Zhong Yi. "Total 2p? Spin Density Mapping as a Function of Hydrogen Bonding Involving an Anion Radical". . p. 5717 - 5720. Retrieved 1990.
• 3、 Panda, Pravati,Nayak, Sabita,Sahoo, Susanta Ku.,Mohapatra, Seetaram,Nayak, Deepika,Pradhan, Rajalaxmi,Kundu, Chanakya Nath. "Diastereoselective synthesis of novel spiro indanone fused pyrano[3,2-: c] chromene derivatives following hetero-Diels-Alder reaction and in vitro anticancer studies". . p. 16802 - 16814. Retrieved 2018/05/23.
• 4、 Itoh, Takayoshi,Tatsugi, Jiro,Tomioka, Hideo. "Photolysis of indan-l,2-dione derivatives in oxygen-doped argon matrix at low temperature". experimental part. p. 475 - 481. Retrieved 2009/08/07.