1,2,3,4,5,6,7,8-Octahydroanthracene

Base Information

• Chemical Name: 1,2,3,4,5,6,7,8-Octahydroanthracene
• CAS No.: 1079-71-6
• Molecular Formula: C14H18
• Molecular Weight: 186.297
• Hs Code.: 2902909090
• European Community (EC) Number: 214-094-8
• NSC Number: 77943
• DSSTox Substance ID: DTXSID90148324
• Nikkaji Number: J7.241I
• Wikidata: Q83013842
• Mol file: 1079-71-6.mol

Synonyms:1,2,3,4,5,6,7,8-Octahydroanthracene;1079-71-6;sym-Octahydroanthracene;Anthracene, 1,2,3,4,5,6,7,8-octahydro-;s-Octahydroanthracene;EINECS 214-094-8;NSC 77943;1,2,3,4,5,6,7,8-octahydro-anthracene;NSC77943;NCIOpen2_000945;DTXSID90148324;NSC-77943;AKOS006274547;1,3,4,5,6,7,8-Octahydroanthracene;BS-53216;Anthracene,2,3,4,5,6,7,8-octahydro-;CS-0233388;FT-0693799;E74001;EN300-133176;Z1198147736

Chemical Property of 1,2,3,4,5,6,7,8-Octahydroanthracene

Chemical Property:

• Vapor Pressure: 0.00147mmHg at 25°C
• Melting Point: 78°C
• Refractive Index: 1.5372
• Boiling Point: 305.6°Cat760mmHg
• Flash Point: 136.4°C
• PSA: 0.00000
• Density: 1.017g/cm³
• LogP: 3.44420
• XLogP3: 4.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 186.140850574
• Heavy Atom Count: 14
• Complexity: 154

Purity/Quality:

98%,99%, ^*data from raw suppliers

1,2,3,4,5,6,7,8-OCTAHYDROANTHRACENE Aldrich ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Chemical Classes: Other Classes -> Polycyclic Aromatic Hydrocarbons
• Canonical SMILES: C1CCC2=CC3=C(CCCC3)C=C2C1

Technology Process of 1,2,3,4,5,6,7,8-Octahydroanthracene

There total 107 articles about 1,2,3,4,5,6,7,8-Octahydroanthracene 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: 52.3%

anthracene (120-12-7) → 9,10-dihydroanthracene (613-31-0) + 1,2,3,4,5,6,7,8,9,10-hexahydroanthracene (3485-60-7) + 1,2,3,4-tetrahydroanthracene (2141-42-6) + 1,2,3,4,5,6,7,8-octahydroanthracene (1079-71-6)

Guidance literature:

With hydrogen; lithium aluminium tetrahydride; titanium tetrachloride; In n-heptane; at 200 ℃; for 3h; under 67505.4 Torr; Further byproducts given;

Reference yield: 28.0%

anthracene (120-12-7) → 9,10-dihydroanthracene (613-31-0) + 1,2,3,4,5,6,7,8,9,10-hexahydroanthracene (3485-60-7) + 1,2,3,4,9,10,11,12-octahydroanthracene (7389-11-9,85281-16-9) + 1,2,3,4-tetrahydroanthracene (2141-42-6) + 1,2,3,4,5,6,7,8-octahydroanthracene (1079-71-6)

Guidance literature:

With hydrogen; lithium aluminium tetrahydride; titanium tetrachloride; In n-heptane; at 200 ℃; for 3h; under 67505.4 Torr; Product distribution; other conditions: other solvents (diglyme, nonane, hexane), other times, other catalysts, other reagents (D₂O, H₂O/LiAlD₄), other temperatures;;

Reference yield: 16.0%

anthracene (120-12-7) → 9,10-dihydroanthracene (613-31-0) + 1,2,3,4,5,6,7,8,9,10-hexahydroanthracene (3485-60-7) + 1,4,5,8,9,10-hexahydroanthracene (5910-28-1) + 1,2,3,4,5,6,7,8-octahydroanthracene (1079-71-6)

Guidance literature:

With tetra(n-butyl)ammonium hydroxide; In water; at 80 ℃; electrolysis, 10 F/mol, divided cell;

DOI:10.1016/S0040-4020(01)90597-6

upstream raw materials:

9,10-dihydroanthracene

tetralin

Isopropyl acetate

1-hydroxyanthracene

Downstream raw materials:

9-chloromethyl-1,2,3,4,5,6,7,8-octahydro-anthracene

1,2,4,5-benzenetetracarboxylic acid

anthracene

1,2,3,4,5,6,7,8-Octahydrophenanthrene

Refernces

• 1、 Avila, David V.,Davies, Alwyn G.,Girbal, Maria L.. "Conformational Inversion in the Dodecahydrotriphenylene Radical Cation". . p. 1999 - 2008. Retrieved 1990.
• 2、 Ward, Michael D.,Schwartz, Jeffrey. "Silica-Bound Rhodium Hydride Catalysts for Arene Hydrogenation". . p. 5253 - 5255. Retrieved 1981.
• 3、 Thummel,Nukatul. "-". . p. 3170,3172. Retrieved 1978.
• 4、 Sawama, Yoshinari,Mori, Misato,Yamada, Tsuyoshi,Monguchi, Yasunari,Sajiki, Hironao. "Hydrogen Self-Sufficient Arene Reduction to Cyclohexane Derivatives Using a Combination of Platinum on Carbon and 2-Propanol". . p. 3667 - 3670. Retrieved 2015.
• 5、 Kolobielski,M.. "-". . p. 1883 - 1885. Retrieved 1963.
• 6、 Buchanan, A. C.,Dworkin, A. S.,Smith, G. P.. "Hydride Abstraction from 9,10-Dihydroanthracene and 5,12-Dihydronaphthacene in an Aprotic Molten Salt Medium". . p. 471 - 473. Retrieved 1981.
• 7、 Park, Kang Hyun,Jang, Kwonho,Kim, Hae Jin,Son, Seung Uk. "Near-monodisperse tetrahedral rhodium nanoparticles on charcoal: The shape-dependent catalytic hydrogenation of arenes". . p. 1152 - 1155. Retrieved 2007.
• 8、 Huyen, Pham Thanh,Krivec, Marko,Ko?evar, Marijan,Bucur, Ioana C.,Rizescu, Cristina,Parvulescu, Vasile I.. "Hydrogenation of Condensed Aromatic Compounds over Mesoporous Bifunctional Catalysts Following a Diels-Alder Adduct Pathway". . p. 1146 - 1156. Retrieved 2016.
• 9、 Mitsuhashi, Tsutomu,Goto, Midori,Honda, Kazumasa,Maruyama, Yusei,Inabe, Tamotsu,et. al.. "A Twin-TCNQ-Type Acceptor. Synthesis of 11,11,12,12,13,13,14,14-Octacyano-1,4:5,8-anthradiquinotetramethane and Structures of the Tetraethylammonium Salts of Its Mono- and Dianion". . p. 261 - 270. Retrieved 1988.
• 10、 Waterman,Leendertse,Cranendonk. "-". . p. 83,88. Retrieved 1939.