Cas no 637-88-7 (1,4-Cyclohexanedione)

1,4-Cyclohexanedione (CAS 637-88-7) is a cyclic diketone with the molecular formula C?H?O?. This compound is characterized by its two carbonyl groups positioned at the 1 and 4 locations of a cyclohexane ring, making it a versatile intermediate in organic synthesis. It is particularly valued for its role in the production of pharmaceuticals, agrochemicals, and specialty polymers. The compound's reactivity in condensation and reduction reactions allows for the synthesis of heterocyclic compounds and functionalized cyclohexane derivatives. Its high purity and stability under standard conditions make it suitable for precise laboratory and industrial applications. 1,4-Cyclohexanedione is typically supplied as a white to off-white crystalline solid with a defined melting point range.
1,4-Cyclohexanedione structure
1,4-Cyclohexanedione structure
Product Name:1,4-Cyclohexanedione
CAS No:637-88-7
MF:C6H8O2
MW:112.126522064209
MDL:MFCD00001606
CID:39357
PubChem ID:24857482
Update Time:2025-05-20

1,4-Cyclohexanedione Chemical and Physical Properties

Names and Identifiers

    • 1,4-Cyclohexanedione
    • tetrahydro-p-benzoquinone
    • 1,4-Cyclohexandion
    • Cyclohexane-1,4-dione
    • FT-0665352
    • C08063
    • SCHEMBL150852
    • AI3-22410
    • 1,4-Dioxocyclohexane
    • EINECS 211-306-0
    • BP-30065
    • 1,4 cyclohexane dione
    • Q2806566
    • 1,4-Cyclohexanedione-2,2,3,3,5,5,6,6-d8
    • 1,4-Cyclohexandione
    • DTXSID6060929
    • 3-METHYLURICACID
    • NSC-7192
    • bmse000513
    • AKOS005146041
    • NSC 7192
    • FT-0606825
    • MFCD00001606
    • BJS27Z99AM
    • 1,4-cyclohexane-dione
    • CS-W011270
    • SY002914
    • InChI=1/C6H8O2/c7-5-1-2-6(8)4-3-5/h1-4H
    • Z877626718
    • 1,4-Cyclohexanedione, purum, >=98.0% (GC)
    • NSC7192
    • UNII-BJS27Z99AM
    • 1,4-Cyclohexanedione, Vetec(TM) reagent grade, 98%
    • cyclohexane-1,4-quinone
    • 1,4-Cyclohexanedione, 98%
    • NS00035568
    • EN300-58858
    • A834527
    • TETRAHYDROQUINONE
    • Cyclohexan-1,4-dione
    • CHEBI:28286
    • PS-5321
    • J-520151
    • F11265
    • 637-88-7
    • 1,4-Cyclohexane-dione,97%
    • DTXCID5044071
    • DB-311515
    • 1,4-Dioxocyclohexane; NSC 7192; Tetrahydroquinone;
    • STK335618
    • BBL027348
    • 1,4Dioxocyclohexane
    • HY-W010554
    • MDL: MFCD00001606
    • Inchi: 1S/C6H8O2/c7-5-1-2-6(8)4-3-5/h1-4H2
    • InChI Key: DCZFGQYXRKMVFG-UHFFFAOYSA-N
    • SMILES: O=C1CCC(CC1)=O
    • BRN: 774152

Computed Properties

  • Exact Mass: 112.05200
  • Monoisotopic Mass: 112.052
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 8
  • Rotatable Bond Count: 0
  • Complexity: 98.5
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: 4
  • XLogP3: -0.6
  • Topological Polar Surface Area: 34.1A^2

Experimental Properties

  • Color/Form: Colorless crystals
  • Density: 1.0861
  • Melting Point: 77-78.5?°C (lit.)
  • Boiling Point: 132°C/20mmHg(lit.)
  • Flash Point: Fahrenheit: 269.6 ° f < br / > Celsius: 132 ° C < br / >
  • Refractive Index: 1.4570 (estimate)
  • Solubility: Soluble in methanol and ethanol.
  • Stability/Shelf Life: Stable. Combustible. Incompatible with strong oxidizing agents.
  • PSA: 34.14000
  • LogP: 0.69860
  • Solubility: Soluble in water, ethanol, ether, acetone, benzene and chloroform.

1,4-Cyclohexanedione Security Information

1,4-Cyclohexanedione Customs Data

  • HS CODE:29142900
  • Customs Data:

    China Customs Code:

    2914299000

    Overview:

    2914299000. Other cycloalkanones without other oxygen-containing groups\Cyclic enone or cyclic terpenone. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:5.5%. general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to, Acetone declared packaging

    Summary:

    2914299000. other cyclanic, cyclenic or cyclotherpenic ketones without other oxygen function. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:5.5%. General tariff:30.0%

1,4-Cyclohexanedione Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
XI GE MA AO DE LI QI ( SHANG HAI ) MAO YI Co., Ltd.
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¥300.31 2023-12-10
XI GE MA AO DE LI QI ( SHANG HAI ) MAO YI Co., Ltd.
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XI GE MA AO DE LI QI ( SHANG HAI ) MAO YI Co., Ltd.
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SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd.
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SHANG HAI YI EN HUA XUE JI SHU Co., Ltd.
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¥132 2024-05-22
SHANG HAI YI EN HUA XUE JI SHU Co., Ltd.
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¥39 2024-05-22
SHANG HAI YI EN HUA XUE JI SHU Co., Ltd.
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637-88-7 99%
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¥641 2024-05-22
TRC
C987990-5g
1,4-Cyclohexanedione
637-88-7
5g
$ 138.00 2023-09-08
TRC
C987990-25g
1,4-Cyclohexanedione
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$ 178.00 2023-09-08
TRC
C987990-100g
1,4-Cyclohexanedione
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$ 316.00 2023-09-08

1,4-Cyclohexanedione Suppliers

Suzhou Senfeida Chemical Co., Ltd
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(CAS:637-88-7)1,4-Cyclohexanedione
Order Number:sfd15639
Stock Status:in Stock
Quantity:200kg
Purity:99.9%
Pricing Information Last Updated:Friday, 19 July 2024 14:37
Price ($):discuss personally
Jiangsu Xinsu New Materials Co., Ltd
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(CAS:637-88-7)
Order Number:SFD2047
Stock Status:
Quantity:25KG,200KG,1000KG
Purity:99%
Pricing Information Last Updated:Wednesday, 11 December 2024 17:03
Price ($):
Tiancheng Chemical (Jiangsu) Co., Ltd
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(CAS:637-88-7)1,4-環(huán)己二酮
Order Number:LE2471767
Stock Status:in Stock
Quantity:25KG,200KG,1000KG
Purity:99%
Pricing Information Last Updated:Friday, 20 June 2025 12:39
Price ($):discuss personally

1,4-Cyclohexanedione Related Literature

Additional information on 1,4-Cyclohexanedione

1,4-Cyclohexanedione: A Comprehensive Overview

1,4-Cyclohexanedione, also known by its CAS number CAS No. 637-88-7, is a cyclic diketone compound with a six-membered ring structure. This compound has garnered significant attention in various fields due to its unique chemical properties and versatile applications. Recent studies have highlighted its potential in drug discovery, material science, and organic synthesis.

The molecular structure of 1,4-Cyclohexanedione consists of a cyclohexane ring with two ketone groups located at the 1 and 4 positions. This arrangement imparts the molecule with a high degree of symmetry and reactivity. The compound is typically synthesized through oxidation reactions or cyclization processes, depending on the starting materials used. Researchers have explored various synthetic pathways to optimize the yield and purity of CAS No. 637-88-7, which is crucial for its application in advanced materials.

In the field of drug discovery, 1,4-Cyclohexanedione has shown promise as a scaffold for developing bioactive molecules. Its ability to form hydrogen bonds and participate in conjugation makes it an ideal candidate for designing drugs targeting specific biological pathways. Recent studies have demonstrated its potential in inhibiting enzymes associated with neurodegenerative diseases, such as Alzheimer's disease.

The compound also finds application in material science, particularly in the development of advanced polymers and coatings. Its diketone groups can undergo various condensation reactions, leading to the formation of cross-linked networks with enhanced mechanical and thermal properties. Researchers have reported the use of CAS No. 637-88-7 in creating high-performance adhesives and corrosion-resistant coatings.

In terms of environmental impact, recent research has focused on the biodegradation and toxicity of 1,4-Cyclohexanedione. Studies indicate that under certain conditions, the compound can be metabolized by microorganisms, reducing its persistence in the environment. However, further investigations are required to fully understand its ecological implications.

The synthesis and characterization of CAS No. 637-88-7 have been extensively studied using modern analytical techniques such as nuclear magnetic resonance (NMR) spectroscopy and mass spectrometry. These methods provide detailed insights into the molecular structure and reactivity of the compound, enabling researchers to design more efficient synthetic routes.

In conclusion, 1,4-Cyclohexanedione (CAS No. 637-88-7) is a multifaceted compound with applications spanning drug discovery, material science, and organic synthesis. Its unique chemical properties and reactivity continue to drive innovative research across various disciplines.

Recommended suppliers
Suzhou Senfeida Chemical Co., Ltd
(CAS:637-88-7)1,4-Cyclohexanedione
sfd15639
Purity:99.9%
Quantity:200kg
Price ($):Inquiry
Email
Jiangsu Xinsu New Materials Co., Ltd
(CAS:637-88-7)
SFD2047
Purity:99%
Quantity:25KG,200KG,1000KG
Price ($):Inquiry
Email