Cas no 6876-23-9 (trans-1,2-Dimethylcyclohexane)

Technical Introduction: trans-1,2-Dimethylcyclohexane trans-1,2-Dimethylcyclohexane (C?H??) is a cycloalkane derivative characterized by two methyl groups in the trans configuration at the 1 and 2 positions of the cyclohexane ring. This stereochemistry imparts greater steric stability compared to its cis counterpart, resulting in lower ring strain and enhanced conformational rigidity. The compound is commonly utilized as a model system in stereochemical studies, organic synthesis, and as a nonpolar solvent in specialized applications. Its well-defined structure and predictable reactivity make it valuable for mechanistic investigations and as a reference standard in chromatographic analysis. The trans configuration also contributes to its distinct physical properties, including melting and boiling points, which differ from those of cis-1,2-dimethylcyclohexane.
trans-1,2-Dimethylcyclohexane structure
trans-1,2-Dimethylcyclohexane structure
Product Name:trans-1,2-Dimethylcyclohexane
CAS No:6876-23-9
MF:C8H16
MW:112.21264
MDL:MFCD00001505
CID:507309
PubChem ID:87567337
Update Time:2025-05-20

trans-1,2-Dimethylcyclohexane Chemical and Physical Properties

Names and Identifiers

    • trans-1,2-Dimethylcyclohexane
    • 1,trans-2-Dimethylcyclohexane
    • Cyclohexane,1,2-dimethyl-, (1R,2R)-rel-
    • (+/-)-trans-1,2-dimethylcyclohexane
    • 1,2-dimethyl-2,5-dihydro-1
    • 1,2-dimethyl-2,5-dihydro-1h-phosphole 1-oxide
    • 1,2r-dimethyl-2,5-dihydro-1H-phosphole 1t-oxide
    • 1,2-trans-dimethylcyclohexane
    • cis-1,2-Dimethyl-3-phospholinoxid
    • trans-1,2-Dimethyl-3-phospholenoxid
    • trans-1,2-dimethylbenzene
    • trans-Hexahydro-o-xylene
    • EINECS 229-979-4
    • CHEBI:188237
    • (1R,2R)-1,2-dimethylcyclohexane
    • Cyclohexane, 1,2-dimethyl-, (1R,2R)-
    • Cyclohexane, 1,2-dimethyl-, (1R,2R)-rel-
    • Cyclohexane, trans-1,2-dimethyl-
    • UNII-HKG4AHC8VR
    • trans-1,2-dimethyl-cyclohexane
    • DTXSID30858753
    • (1R)-trans-1,2-dimethyl-cyclohexane
    • 1,2-Dimethylcyclohexane, trans-
    • 1,2-Dimethylcyclohexane, (1R,2R)-
    • HKG4AHC8VR
    • 6876-23-9
    • t-1,2-Dimethylcyclohexane
    • trans-1,2-Dimethylcyclohexane, 99%
    • NSC-74158
    • NSC 74158
    • AI3-28850
    • 1,2-dimethyl(trans)-cyclohexane
    • LMFA11000637
    • SJL41NX55V
    • Cyclohexane, 1,2-dimethyl-, trans-
    • AKOS015913284
    • CYCLOHEXANE, 1,2-DIMETHYL-, (E)
    • UNII-SJL41NX55V
    • 203319-65-7
    • D0697
    • MDL: MFCD00001505
    • Inchi: InChI=1S/C8H16/c1-7-5-3-4-6-8(7)2/h7-8H,3-6H2,1-2H3/t7-,8-/m0/s1
    • InChI Key: KVZJLSYJROEPSQ-HTQZYQBOSA-N
    • SMILES: C[C@H]1CCCC[C@@H]1C

Computed Properties

  • Exact Mass: 112.12500
  • Monoisotopic Mass: 112.125200510g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 8
  • Rotatable Bond Count: 0
  • Complexity: 56.4
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 2
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.8
  • Topological Polar Surface Area: 0?2

Experimental Properties

  • Density: 0.77?g/mL?at 25?°C(lit.)
  • Melting Point: ?89?°C (lit.)
  • Boiling Point: 123-124?°C(lit.)
  • Flash Point: Fahrenheit: 44.6 ° f
    Celsius: 7 ° c
  • Refractive Index: n20/D 1.427(lit.)
  • PSA: 0.00000
  • LogP: 2.83260
  • Vapor Pressure: 36.6 mmHg ( 37.7 °C)

trans-1,2-Dimethylcyclohexane Security Information

trans-1,2-Dimethylcyclohexane Customs Data

  • HS CODE:2902199090
  • Customs Data:

    China Customs Code:

    2902199090

    Overview:

    2902199090 Other naphthenic hydrocarbons\Cyclic olefins and cyclic terpenes.Regulatory conditions:nothing.VAT:17.0%.Tax refund rate:9.0%.MFN tariff:2.0%.general tariff:30.0%

    Declaration elements:

    Product Name, component content

    Summary:

    2902199090 other cyclanes, cyclenes and cyclotherpenes.Supervision conditions:None.VAT:17.0%.Tax rebate rate:9.0%.MFN tariff:2.0%.General tariff:30.0%

trans-1,2-Dimethylcyclohexane Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd.
T162890-1ml
trans-1,2-Dimethylcyclohexane
6876-23-9 >99.0%(GC)
1ml
¥125.90 2023-08-31
SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd.
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SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd.
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SHANG HAI XIAN DING Biotechnology Co., Ltd.
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TI XI AI ( SHANG HAI ) HUA CHENG GONG YE FA ZHAN Co., Ltd.
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¥460.00 2024-04-16
TI XI AI ( SHANG HAI ) HUA CHENG GONG YE FA ZHAN Co., Ltd.
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abcr
AB142217-5 ml
trans-1,2-Dimethylcyclohexane, 99%; .
6876-23-9 99%
5 ml
€70.70 2024-04-16
abcr
AB142217-25 ml
trans-1,2-Dimethylcyclohexane, 99%; .
6876-23-9 99%
25 ml
€176.50 2024-04-16

trans-1,2-Dimethylcyclohexane Suppliers

Tiancheng Chemical (Jiangsu) Co., Ltd
Gold Member
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(CAS:6876-23-9)trans-1,2-Dimethylcyclohexane, ≥ 99.0%
Order Number:LE15197
Stock Status:in Stock
Quantity:25KG,200KG,1000KG
Purity:99%
Pricing Information Last Updated:Friday, 20 June 2025 12:12
Price ($):discuss personally
Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
(CAS:6876-23-9)trans-1,2-Dimethylcyclohexane
Order Number:A1048431
Stock Status:in Stock
Quantity:25g/5g
Purity:99%
Pricing Information Last Updated:Thursday, 29 August 2024 17:26
Price ($):579.0/218.0

Additional information on trans-1,2-Dimethylcyclohexane

Comprehensive Guide to trans-1,2-Dimethylcyclohexane (CAS No. 6876-23-9): Properties, Applications, and Industry Insights

trans-1,2-Dimethylcyclohexane (CAS No. 6876-23-9) is a cyclic hydrocarbon belonging to the class of dimethylcyclohexane isomers. This compound has garnered significant attention in industrial and research applications due to its unique structural properties and versatility. As one of the key cyclohexane derivatives, it plays a crucial role in organic synthesis, material science, and specialty chemical formulations.

The molecular structure of trans-1,2-Dimethylcyclohexane features two methyl groups positioned on opposite sides of the cyclohexane ring, resulting in a trans configuration. This spatial arrangement significantly influences its physical and chemical behavior, including boiling point, solubility, and reactivity. With a molecular formula of C8H16, it is commonly used as a reference compound in stereochemistry studies and conformational analysis.

Recent trends in green chemistry and sustainable solvents have increased interest in trans-1,2-Dimethylcyclohexane as a potential alternative to more hazardous organic solvents. Researchers are exploring its applications in low-toxicity formulations and eco-friendly industrial processes, aligning with global sustainability goals. The compound's stability and relatively low environmental impact make it attractive for various green chemistry applications.

In the pharmaceutical industry, trans-1,2-Dimethylcyclohexane serves as an important intermediate in the synthesis of complex organic molecules. Its rigid cyclohexane backbone provides structural stability, while the methyl groups offer sites for further functionalization. This makes it valuable for developing chiral building blocks and pharmaceutical intermediates, particularly in asymmetric synthesis.

The material science field utilizes trans-1,2-Dimethylcyclohexane in polymer research and specialty material development. Its incorporation into polymer chains can influence material properties such as thermal stability, mechanical strength, and crystallinity. Recent studies have investigated its potential in creating advanced polymeric materials with tailored characteristics for specific applications.

From an analytical chemistry perspective, trans-1,2-Dimethylcyclohexane is frequently used as a standard in gas chromatography and mass spectrometry due to its well-defined properties and predictable behavior. Its distinct retention time and mass fragmentation pattern make it valuable for instrument calibration and method development in analytical laboratories.

The production and handling of trans-1,2-Dimethylcyclohexane require specialized knowledge of organic synthesis techniques and chemical safety protocols. While not classified as hazardous under normal conditions, proper storage in airtight containers away from oxidizers is recommended to maintain purity and stability. Industrial-scale production typically involves catalytic hydrogenation of corresponding aromatic precursors or isomerization reactions of related cyclohexane derivatives.

Market trends indicate growing demand for trans-1,2-Dimethylcyclohexane across multiple industries. The compound's global market is influenced by factors such as research activity in organic chemistry, material science advancements, and the expanding pharmaceutical sector. Quality specifications for commercial grades typically emphasize high purity (>98%) and low levels of related isomers and impurities.

Recent scientific literature highlights novel applications of trans-1,2-Dimethylcyclohexane in nanotechnology and surface chemistry. Researchers are investigating its potential as a molecular template or building block for nanostructured materials. The compound's well-defined geometry and chemical stability make it interesting for molecular self-assembly studies and nanoscale fabrication techniques.

For laboratories and industrial users seeking high-purity trans-1,2-Dimethylcyclohexane, several commercial suppliers offer the compound in various quantities and purity grades. When selecting a supplier, considerations should include analytical certification, packaging integrity, and compliance with relevant quality standards. The compound is typically available in quantities ranging from laboratory-scale (grams) to bulk industrial quantities (kilograms or more).

Future research directions for trans-1,2-Dimethylcyclohexane may focus on expanding its utility in catalytic processes, energy storage materials, and specialty chemical formulations. As industries continue to seek sustainable and efficient chemical solutions, this versatile compound is likely to find new applications in emerging technologies and advanced material systems.

Recommended suppliers
Tiancheng Chemical (Jiangsu) Co., Ltd
(CAS:6876-23-9)trans-1,2-Dimethylcyclohexane, ≥ 99.0%
LE15197
Purity:99%
Quantity:25KG,200KG,1000KG
Price ($):Inquiry
Email
Amadis Chemical Company Limited
(CAS:6876-23-9)trans-1,2-Dimethylcyclohexane
A1048431
Purity:99%/99%
Quantity:25g/5g
Price ($):579.0/218.0
Email