1,2-Epoxydodecane

Base Information

• Chemical Name: 1,2-Epoxydodecane
• CAS No.: 2855-19-8
• Deprecated CAS: 128900-21-0
• Molecular Formula: C12H24O
• Molecular Weight: 184.322
• Hs Code.: 29109000
• European Community (EC) Number: 220-667-3
• NSC Number: 6785
• UN Number: 1993
• UNII: 736974CF3U
• DSSTox Substance ID: DTXSID9025243
• Nikkaji Number: J13.742A
• Wikidata: Q27266143
• ChEMBL ID: CHEMBL3183029
• Mol file: 2855-19-8.mol

Synonyms:1,2-EPOXYDODECANE;2-Decyloxirane;2855-19-8;1-Dodecene oxide;Oxirane, decyl-;Decyloxirane;Decyl oxirane;Dodecene epoxide;Dodecane, 1,2-epoxy-;Nedox 1200;1,2-Dodecane oxide;1,2-Dodecene oxide;1,2-Epoxy-n-dodecene;1,2-Epoxy-N-dodecane;1,2-Dodecylene Oxide;1,2-Epoxydodekan;alpha-Dodecene oxide;Oxirane, 2-decyl-;Dodecane, epoxy-;NSC 6785;CCRIS 2616;HSDB 5538;2-decyl-oxirane;1,2-Epoxydodekan [Czech];EINECS 220-667-3;1-Dodecene Epoxide;BRN 0105569;DTXSID9025243;UNII-736974CF3U;AI3-14199;NSC-6785;2-N-DECYLOXIRANE;736974CF3U;(+/-)-DECYLOXIRANE;1,2-DODECENE EPOXIDE;DTXCID305243;EC 220-667-3;5-17-01-00166 (Beilstein Handbook Reference);(+/-)-1,2-EPOXYDODECANE;2-Decyloxirane #;Dodecane,2-epoxy-;2-(decyl)-oxirane;VIKOLOX 12;(+-)-DECYLOXIRANE;1,2-Epoxydodecane, 90%;1,2-Epoxydodecane, 95%;SCHEMBL52008;WLN: T3OTJ B10;.ALPHA.-DODECENE OXIDE;CHEMBL3183029;NSC6785;(+-)-1,2-EPOXYDODECANE;Tox21_301660;BBL027500;MFCD00005150;OXIRANE, DECYL-, (+-)-;STL373430;AKOS015903513;LS-1129;NCGC00255147-01;BP-26278;VS-08556;CAS-2855-19-8;CS-0152245;D1984;FT-0606449;FT-0773985;D89968;EN300-342618;J-640003;J-800003;W-109829;Q27266143;Z1255485282

Chemical Property of 1,2-Epoxydodecane

Chemical Property:

• Appearance/Colour: clear colorless liquid
• Vapor Pressure: 0.0343mmHg at 25°C
• Refractive Index: 1.435-1.437
• Boiling Point: 250.5 °C at 760 mmHg
• Flash Point: 105 °C
• PSA: 12.53000
• Density: 0.861 g/cm³
• LogP: 3.91600
• Storage Temp.: 2-8°C
• Water Solubility.: Not miscible in water.
• XLogP3: 5.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 9
• Exact Mass: 184.182715385
• Heavy Atom Count: 13
• Complexity: 112
• Transport DOT Label: Flammable Liquid

Purity/Quality:

99.9% ^*data from raw suppliers

EDD ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36-37/39

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Chemical Classes: Plastics & Rubber -> Epoxides
• Canonical SMILES: CCCCCCCCCCC1CO1

Technology Process of 1,2-Epoxydodecane

There total 23 articles about 1,2-Epoxydodecane 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: 93.0%

1-bromododecan-2-yl formate (56946-24-8) → Decyl-oxiran (2855-19-8)

Guidance literature:

With sodium methylate; In methanol; at 20 ℃; for 0.0833333h;

DOI:10.1021/acs.joc.7b00776

Reference yield: 78.0%

dimethylselenonium-2-(1-hydroxy)dodecylmethylfluorosulfonate → Decyl-oxiran (2855-19-8) + 2-methylseleno-1-dodecene

Guidance literature:

With potassium hydroxide; In diethyl ether;

DOI:10.3987/REV-88-SR6

Reference yield:

1-dodecene (112-41-4,25067-08-7,62132-67-6) + cyclohexene (110-83-8) → Decyl-oxiran (2855-19-8) + dodecane-1,2-diol (1119-87-5) + 1,2-Cyclohexanediol (931-17-9) + cyclohexane-1,2-epoxide (286-20-4)

Guidance literature:

With dihydrogen peroxide; In methanol; water; at 64.84 ℃; for 2h; regioselective reaction;

DOI:10.1016/j.molcata.2010.05.024

upstream raw materials:

peracetic acid

1-dodecene

Perbenzoic acid

trifluoroacetyl peroxide

Downstream raw materials:

(E)-β-(1-decyl)styrene

dodecan-2-one

Dodecanal

1-phenyldodecan-2-ol

Refernces

• 1、 Gao, Hanrong,Angelici, Robert J.. "Epoxidation of olefins by molecular oxygen over supported metal heterogeneous catalysts". . p. 1239 - 1247. Retrieved 2000.
• 2、 Wang,Hao,Wang. "A new methodology for synthesis of 1,2-epoxy alkane with the linear aliphatic olefins in presence of molecular oxygen". . p. 1409 - 1414. Retrieved 1999.
• 3、 Haghshenas Kashani, Sara,Moghadam, Majid,Tangestaninejad, Shahram,Mirkhani, Valiollah,Mohammadpoor-Baltork, Iraj. "Ruthenium Nanoparticles Immobilized on Nano-silica Functionalized with Thiol-Based Dendrimer: A Nanocomposite Material for Oxidation of Alcohols and Epoxidation of Alkenes". . p. 1110 - 1123. Retrieved 2018.
• 4、 Biloski, Alan J.,Heggs, Richard P.,Ganem, Bruce. "Catalytic Epoxidation of Alkenes with Hexafluoroacetone/Hydrogen Peroxide: 4,4-Dimethyl-3,5,8-trioxabicyclooctane". . p. 810 - 811. Retrieved 1980.
• 5、 Samani, Mahnaz,Ardakani, Mehdi Hatefi,Sabet, Mohammad. "Efficient and selective oxidation of hydrocarbons with tert-butyl hydroperoxide catalyzed by oxidovanadium(IV) unsymmetrical Schiff base complex supported on γ-Fe2O3 magnetic nanoparticles". . p. 1481 - 1494. Retrieved 2022/01/22.
• 6、 Mao, Shuxin,Budweg, Svenja,Spannenberg, Anke,Wen, Xiaodong,Yang, Yong,Li, Yong-Wang,Junge, Kathrin,Beller, Matthias. "Iron-Catalyzed Epoxidation of Linear α-Olefins with Hydrogen Peroxide". . . Retrieved 2022/01/26.