Cas no 1079-71-6 (1,2,3,4,5,6,7,8-octahydroanthracene)

1,2,3,4,5,6,7,8-Octahydroanthracene is a polycyclic hydrocarbon with a fully hydrogenated anthracene structure, offering enhanced stability and reduced reactivity compared to its aromatic counterpart. Its saturated ring system makes it a valuable intermediate in organic synthesis, particularly for hydrogenation studies and the production of specialty chemicals. The compound's rigid, yet flexible, cyclohexane-based framework is useful in materials science for designing thermally stable polymers or liquid crystalline systems. Due to its low volatility and well-defined structure, it is also employed as a model compound in spectroscopic and computational research. Its purity and predictable behavior under catalytic conditions further support its utility in method development and mechanistic investigations.
1,2,3,4,5,6,7,8-octahydroanthracene structure
1079-71-6 structure
Product Name:1,2,3,4,5,6,7,8-octahydroanthracene
CAS No:1079-71-6
MF:C14H18
MW:186.292724132538
CID:182450
PubChem ID:66181
Update Time:2025-06-19

1,2,3,4,5,6,7,8-octahydroanthracene Chemical and Physical Properties

Names and Identifiers

    • Anthracene,1,2,3,4,5,6,7,8-octahydro-
    • 1,2,3,4,5,6,7,8-OCTAHYDROANTHRACENE
    • 1,2,3,4,5,6,7,8-OCTAHYDROANTHRACENE,MP 72-73DEG
    • 1,2,3,4,5,6,7,8-Octahydro-anthracen
    • 1,2,3,4,5,6,7,8-octahydro-anthracene
    • Anthracene,1,2,3,4,5,6,7,8-octahydro
    • lin-bistetramethylene-benzene
    • s-Octahydroanthracene
    • sym-octahydroanthracene
    • NSC 77943
    • Octahydroanthracene
    • E74001
    • EINECS 214-094-8
    • A96H6FM2ET
    • Anthracene, 1,2,3,4,5,6,7,8-octahydro-
    • 1079-71-6
    • NS00023486
    • DTXSID90148324
    • InChI=1/C14H18/c1-2-6-12-10-14-8-4-3-7-13(14)9-11(12)5-1/h9-10H,1-8H
    • BS-53216
    • NCIOpen2_000945
    • LFAYMJXHGYUQNV-UHFFFAOYSA-N
    • NSC77943
    • EN300-133176
    • EINECS 247-884-6
    • Z1198147736
    • NSC-77943
    • AKOS006274547
    • Anthracene, octahydro-
    • FT-0693799
    • 1,3,4,5,6,7,8-Octahydroanthracene
    • CS-0233388
    • Anthracene,2,3,4,5,6,7,8-octahydro-
    • 26655-71-0
    • Anthracene, 1,2,3,4,5,6,7,8-octahydro-(8CI)
    • Anthracene, 1,2,3,4,5,6,7,8-octahydro-(8CI)(9CI)
    • Anthracene, 1,2,3,4,5,6,7,8octahydro (8CI)
    • Anthracene, 1,2,3,4,5,6,7,8octahydro (8CI)(9CI)
    • symOctahydroanthracene
    • DTXCID0070815
    • 1,2,3,4,5,6,7,8Octahydroanthracene
    • 1,2,3,4,5,6,7,8-octahydroanthracene
    • Inchi: 1S/C14H18/c1-2-6-12-10-14-8-4-3-7-13(14)9-11(12)5-1/h9-10H,1-8H2
    • InChI Key: LFAYMJXHGYUQNV-UHFFFAOYSA-N
    • SMILES: C12C=C3CCCCC3=CC=1CCCC2

Computed Properties

  • Exact Mass: 186.14100
  • Monoisotopic Mass: 186.141
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 0
  • Complexity: 154
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 4.7
  • Topological Polar Surface Area: 0A^2

Experimental Properties

  • Density: 0.9703
  • Melting Point: 78°C
  • Boiling Point: 255.8°C (rough estimate)
  • Flash Point: 136.4°C
  • Refractive Index: 1.5372
  • PSA: 0.00000
  • LogP: 3.44420

1,2,3,4,5,6,7,8-octahydroanthracene Customs Data

  • HS CODE:2902909090
  • Customs Data:

    China Customs Code:

    2902909090

    Overview:

    2902909090. Other aromatic hydrocarbons. VAT:17.0%. Tax refund rate:9.0%. Regulatory conditions:nothing. MFN tariff:2.0%. general tariff:30.0%

    Declaration elements:

    Product Name, component content

    Summary:

    2902909090 other aromatic hydrocarbons.Supervision conditions:None.VAT:17.0%.Tax rebate rate:9.0%.MFN tariff:2.0%.General tariff:30.0%

1,2,3,4,5,6,7,8-octahydroanthracene Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Key Organics Ltd
BS-53216-250MG
1,2,3,4,5,6,7,8-Octahydroanthracene
1079-71-6 >95%
0.25 g
£154.00 2023-04-19
Key Organics Ltd
BS-53216-1G
1,2,3,4,5,6,7,8-Octahydroanthracene
1079-71-6 >95%
1g
£305.00 2025-02-08
Enamine
EN300-133176-0.05g
1,2,3,4,5,6,7,8-octahydroanthracene
1079-71-6 95%
0.05g
$64.0 2023-04-20
Enamine
EN300-133176-0.1g
1,2,3,4,5,6,7,8-octahydroanthracene
1079-71-6 95%
0.1g
$66.0 2023-04-20
Enamine
EN300-133176-0.25g
1,2,3,4,5,6,7,8-octahydroanthracene
1079-71-6 95%
0.25g
$92.0 2023-04-20
Enamine
EN300-133176-0.5g
1,2,3,4,5,6,7,8-octahydroanthracene
1079-71-6 95%
0.5g
$175.0 2023-04-20
Enamine
EN300-133176-1.0g
1,2,3,4,5,6,7,8-octahydroanthracene
1079-71-6 95%
1g
$256.0 2023-04-20
Enamine
EN300-133176-2.5g
1,2,3,4,5,6,7,8-octahydroanthracene
1079-71-6 95%
2.5g
$503.0 2023-04-20
Enamine
EN300-133176-5.0g
1,2,3,4,5,6,7,8-octahydroanthracene
1079-71-6 95%
5g
$743.0 2023-04-20
Enamine
EN300-133176-10.0g
1,2,3,4,5,6,7,8-octahydroanthracene
1079-71-6 95%
10g
$1101.0 2023-04-20

1,2,3,4,5,6,7,8-octahydroanthracene Related Literature

Additional information on 1,2,3,4,5,6,7,8-octahydroanthracene

Chemical Profile of 1,2,3,4,5,6,7,8-octahydroanthracene (CAS No. 1079-71-6)

1,2,3,4,5,6,7,8-octahydroanthracene, identified by the chemical abstracts service number CAS No. 1079-71-6, is a significant polycyclic aromatic hydrocarbon derivative that has garnered considerable attention in the field of organic chemistry and pharmaceutical research. This compound belongs to the family of naphthalene derivatives and is characterized by a fully saturated eight-membered ring system attached to a three-ring aromatic core. The structural configuration of 1,2,3,4,5,6,7,8-octahydroanthracene makes it a versatile intermediate in synthetic chemistry and a potential candidate for various industrial applications.

The molecular structure of this compound consists of a fused triphenyl group with all double bonds replaced by single bonds, resulting in a stable saturated hydrocarbon. This unique structural feature imparts distinct chemical properties that make it valuable in the synthesis of more complex molecules. The compound is typically produced through catalytic hydrogenation processes involving anthracene or its derivatives under controlled conditions. The reaction pathway often employs transition metal catalysts such as palladium or platinum to ensure high selectivity and yield.

In recent years, 1,2,3,4,5,6,7,8-octahydroanthracene has been explored for its potential applications in pharmaceutical development. Its rigid aromatic core and saturated rings provide a stable scaffold for further functionalization. Researchers have been particularly interested in modifying this compound to develop novel bioactive molecules with therapeutic properties. For instance, derivatives of 1,2,3,4,5,6,7,8-octahydroanthracene have been investigated as precursors for anti-inflammatory agents and kinase inhibitors due to their ability to interact with biological targets effectively.

One of the most compelling aspects of 1,2,3,4,5,6,7,8-octahydroanthracene is its role as a building block in material science. The compound's ability to undergo further chemical modifications allows scientists to design polymers and advanced materials with tailored properties. For example, researchers have utilized derivatives of this molecule to create conductive polymers that exhibit enhanced stability and electrical conductivity. These materials are particularly relevant in the development of flexible electronics and organic semiconductors.

The synthesis and handling of 1,2,3,4,5,6,7,8-octahydroanthracene require careful consideration due to its reactivity and potential interactions with other compounds. Industrial-scale production often involves specialized equipment to maintain purity and prevent unwanted side reactions. Recent advancements in catalytic processes have improved the efficiency of producing this compound while minimizing environmental impact. These innovations align with global efforts to develop greener synthetic methodologies.

Recent studies have also highlighted the importance of 1,2,3,4,5,6,7,8-octahydroanthracene in understanding metabolic pathways and drug metabolism. Researchers have observed that certain derivatives of this compound can influence enzyme activity and metabolic rates in biological systems. This insight has opened new avenues for developing drugs that target specific metabolic pathways for therapeutic benefit.

The commercial significance of CAS No. 1079-71-6 cannot be overstated. As demand for high-performance materials and pharmaceutical intermediates grows, so does the need for reliable sources of this compound。 Manufacturers are continuously refining production techniques to meet industry standards while ensuring cost-effectiveness and scalability. This trend reflects the broader shift toward sustainable chemistry practices that prioritize efficiency and environmental responsibility.

In conclusion,1,2,3,4,5,6,7,8-octahydroanthracene (CAS No. 1079-71-6) remains a cornerstone in both academic research and industrial applications across multiple disciplines。 Its unique structural properties make it indispensable for developing new materials and pharmaceuticals。 As scientific understanding evolves , so too will the ways in which this compound is utilized , driving innovation across chemistry , medicine , and materials science.

Recommended suppliers
Xiamen PinR Bio-tech Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Xiamen PinR Bio-tech Co., Ltd.
Jinan Hanyu Chemical Co.,Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Jinan Hanyu Chemical Co.,Ltd.
Shenzhen GeneSeqTools Bioscience & Technology Co. Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Shenzhen GeneSeqTools Bioscience & Technology Co. Ltd.
Jinta Yudi Pharmaceutical Technology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Jinta Yudi Pharmaceutical Technology Co., Ltd.
PRIBOLAB PTE.LTD
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
PRIBOLAB PTE.LTD