3,4,5,6,7,8-Hexahydro-5,5,8,8-tetramethylanthracen-1(2H)-one

Base Information

Chemical Name:3,4,5,6,7,8-Hexahydro-5,5,8,8-tetramethylanthracen-1(2H)-one
CAS No.:93940-28-4
Molecular Formula:C18H24 O
Molecular Weight:256.388
Hs Code.:2914399090
European Community (EC) Number:300-422-8
DSSTox Substance ID:DTXSID60239910
Nikkaji Number:J310.449D
Wikidata:Q83122453
Mol file:93940-28-4.mol

Synonyms:EINECS 300-422-8;3,4,5,6,7,8-Hexahydro-5,5,8,8-tetramethylanthracen-1(2H)-one;93940-28-4;SCHEMBL6915238;DTXSID60239910;TUWBVBYVXBXGFD-UHFFFAOYSA-N;3,4,5,6,7,8-hexahydro-5,5,8,8-tetramethyl-2h-anthracen-1-one

Suppliers and Price of 3,4,5,6,7,8-Hexahydro-5,5,8,8-tetramethylanthracen-1(2H)-one

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
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price

Total 5 raw suppliers

Chemical Property of 3,4,5,6,7,8-Hexahydro-5,5,8,8-tetramethylanthracen-1(2H)-one

Chemical Property:

Vapor Pressure:1.06E-05mmHg at 25°C
Boiling Point:371.1°Cat760mmHg
Flash Point:158.5°C
PSA：17.07000
Density:0.999g/cm³
LogP:4.55460
XLogP3:5.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:0
Exact Mass:256.182715385
Heavy Atom Count:19
Complexity:379

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1(CCC(C2=C1C=C3CCCC(=O)C3=C2)(C)C)C

Technology Process of 3,4,5,6,7,8-Hexahydro-5,5,8,8-tetramethylanthracen-1(2H)-one

There total 6 articles about 3,4,5,6,7,8-Hexahydro-5,5,8,8-tetramethylanthracen-1(2H)-one 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: 35.0%

: 93940-28-4
3,4,5,6,7,8-hexahydro-5,5,8,8-tetramethyl-2H-anthracen-1-one

Guidance literature:

Reference yield:

: 1026950-90-2
4-(5,5,8,8-Tetramethyl-5,6,7,8-tetrahydro-naphthalen-2-yl)-butyryl chloride

: 93940-28-4
3,4,5,6,7,8-hexahydro-5,5,8,8-tetramethyl-2H-anthracen-1-one

Guidance literature:: With aluminium trichloride; In carbon disulfide; for 4h; Yield given; Heating;
DOI:10.1021/jm00016a020

Reference yield:

: 6683-46-1
1,1,4,4-Tetramethyl-1,2,3,4-tetrahydro-naphthalene

: 93940-28-4
3,4,5,6,7,8-hexahydro-5,5,8,8-tetramethyl-2H-anthracen-1-one

Guidance literature:: Multi-step reaction with 5 steps

1: AlCl₃ / CH₂Cl₂ / 6 h / Ambient temperature

2: 5 N NaOH / ethanol / 3 h / Ambient temperature

3: NaOH, hydrazine monohydrate, diethylene glycol / 6 h / 140 °C

4: thionyl chloride / benzene / 0.67 h / Heating

5: AlCl₃ / CS₂ / 4 h / Heating

With sodium hydroxide; aluminium trichloride; thionyl chloride; hydrazine hydrate; diethylene glycol; In carbon disulfide; ethanol; dichloromethane; benzene;
DOI:10.1021/jm00016a020