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504-02-9

  • Product Name1,3-Cyclohexanedione
  • Molecular FormulaC6H8O2
  • Purity99%
  • Appearancebeige crystalline powder
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Product Details

Quick Details

  • CasNo: 504-02-9
  • Molecular Formula: C6H8O2
  • Appearance: beige crystalline powder
  • Purity: 99%

We supply Pharmaceutical Intermediates 1,3-Cyclohexanedione. 1,3-Cyclohexanedione is one of three isomeric cyclohexanediones.

 

Pharmaceutical Intermediates 1,3-Cyclohexanedione 504-02-9 Global

504-02-9 Name

Name

1,3-Cyclohexanedione

Synonym

Dihydro-1,3-benzenediol;NSC 57477;1,3-Cyclohexanedione, 97% 500GR;1,3-Cyclohexanedione 97%;1,3-Cyclohexanedione SynonyMs Cyclohexane-1,3-dione;1,3-Cyclohexanedione, 97+%, may cont. up to 1% NaCl;1,3-Cyclohexanedione [for HPLC Labeling];1,3-Diketocyclohexane

504-02-9 Chemical & Physical Properties

Melting point 

101-105 °C(lit.)

Boiling point

235.1±23.0 °C at 760 mmHg

Density

1.1±0.1 g/cm3

Molecular Formula

C6H8O2

Molecular Weight

112.127

Flash Point

85.7±19.6 °C

PSA

34.14000

LogP

-0.89

Exact Mass

112.052429

Vapour Pressure

0.1±0.5 mmHg at 25°C

Index of Refraction

1.474

Storage condition

2-8°C

Water Solubility

soluble

1,3-Cyclohexanedione 504-02-9 Usage

1,3-Cyclohexanedione is a chemical compound that has been studied in various scholarly articles for its potential applications as a pharmaceutical intermediate. It can be used as a starting material for the synthesis of various pharmaceuticals, such as antihistamines, antibiotics, and anticancer drugs. Additionally, 1,3-Cyclohexanedione has been investigated for its potential applications as a chelating agent in the treatment of metal poisoning. It has been found to have high affinity for certain metal ions, such as lead and mercury, and can be used to remove these toxins from the body. Furthermore, 1,3-Cyclohexanedione has been studied for its potential applications in the production of polymers and resins. However, it is important to note that 1,3-Cyclohexanedione is a hazardous chemical and should be handled with care. Overall, 1,3-Cyclohexanedione is a versatile compound with a wide range of potential applications in various fields, particularly in the pharmaceutical industry.

InChI:InChI=1/C6H8O2/c7-5-2-1-3-6(8)4-5/h4,7H,1-3H2

1,3-Cyclohexanedione 504-02-9 Relevant articles

Solid-state structural characterization of 1,3-cyclohexanedione and of a 6:1 cyclohexanedione-benzene cyclamer complex, a novel host-guest species.

ETTER, M. C.,URBANCZYK-LIPKOWSKA, Z.,JAHN, D. A.,FRYE, J. S.

Cheminform 1987

1,3-Cyclohexanedione crystallizes form a variety of organic solvents such as THF as flat, clear trapezoidal crystals (space group P2 1 /a, Z=4) containing strongly H-bonded anti-anti configurated chains.

Preparation method of 1,3-cyclohexanedione

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Paragraph 0068-0095, (2020/07/13)

The invention relates to the field of organic synthesis, and discloses a preparation method of 1,3-cyclohexanedione. The preparation method disclosed by the invention has the advantages of high purity and high yield of the prepared 1,3-cyclohexanedione.

Method for synthesizing 1,3-cyclohexanedione by utilizing platinum-carbon catalytic reaction

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Paragraph 0014-0024, (2020/04/06)

According to the invention, the platinum-carbon catalyst adopted as a reduction reaction catalyst has great economic advantages and great safety advantages compared with the traditional Raney nickel catalyst, the risk easily occurring during the production process is avoided, and the yield and the quality of the product are improved.

Preparation method of 1,3-cyclohexanedione

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Paragraph 0013; 0026-0030; 0036-0045; 0061, (2020/06/09)

The preparation method of the 1,3-cyclohexanedione hasthe advantages that process conditions are convenient to realize, post-treatment operation process is simple, yield is as high as 90.9%, reaction selectivity is high, production efficiency is high, operation safety is high, pollution is small, and the preparation method is suitable for industrial scale production.

504-02-9 Process route

cyclohexa-1,4-diene
1165952-92-0

cyclohexa-1,4-diene

cyclohexenone
930-68-7

cyclohexenone

cyclohex-3-enone
4096-34-8

cyclohex-3-enone

1,3-cylohexanedione
504-02-9

1,3-cylohexanedione

1,4-Cyclohexanedione
637-88-7

1,4-Cyclohexanedione

Conditions
Conditions Yield
With dinitrogen monoxide; at 250 ℃; for 5h; pressure;
 
cyclohexane-1,3-dione sodium enolate
1874-83-5

cyclohexane-1,3-dione sodium enolate

1,3-cylohexanedione
504-02-9

1,3-cylohexanedione

Conditions
Conditions Yield
With hydrogenchloride; In water; at 15 - 20 ℃;
96.43%

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