Oxirane, 2,3-diethyl-, cis-

Base Information

• Chemical Name: Oxirane, 2,3-diethyl-, cis-
• CAS No.: 36611-94-6
• Molecular Formula: C6H12O
• Molecular Weight: 100.161
• DSSTox Substance ID: DTXSID20450705
• Nikkaji Number: J1.599.595E
• Wikidata: Q82270507
• Mol file: 36611-94-6.mol

Synonyms:Oxirane, 2,3-diethyl-, cis-;36611-94-6;cis-2,3-diethyloxirane;2alpha,3alpha-Diethyloxirane;SCHEMBL13545604;DTXSID20450705

Chemical Property of Oxirane, 2,3-diethyl-, cis-

Chemical Property:

• XLogP3: 1.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 100.088815002
• Heavy Atom Count: 7
• Complexity: 53.2

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC1C(O1)CC
• Isomeric SMILES: CC[C@@H]1[C@@H](O1)CC

Technology Process of Oxirane, 2,3-diethyl-, cis-

There total 2 articles about Oxirane, 2,3-diethyl-, cis- 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:

hexane (110-54-3) → oxirane (75-21-8,99932-75-9) + 2-ethyltetrahydrofuran (1003-30-1,123931-62-4) + 2-ethyl-4-methyloxetane (5410-21-9) + 2,5-dimethyltetrahydrofuran (1003-38-9) + 2-methyloxane (10141-72-7) + 2,3-diethyloxirane (4468-66-0,36611-93-5,36611-94-6,124718-82-7,135559-58-9,149951-15-5) + 1,2-Epoxyhexane (1436-34-6) + 2,3-epoxyhexane (1192-32-1) + 2-propyl-oxetane (4468-64-8) + methanol (67-56-1) + Ketene (463-51-4) + formaldehyd (50-00-0,30525-89-4,61233-19-0) + propene (187737-37-7,13987-01-4,15220-87-8,9003-07-0,676-63-1,25085-53-4) + methane (34557-54-5,27936-85-2) + ethane (74-84-0) + ethene (74-85-1) + 1,2-propanediene (463-49-0) + acetaldehyde (75-07-0,9002-91-9) + acetic acid (64-19-7,77671-22-8) + propionic acid (802294-64-0,79-09-4) + buta-1,3-diene (106-99-0,130983-70-9,29406-96-0,9003-17-2) + methyloxirane (75-56-9,16033-71-9) + prop-1-yne (74-99-7) + acetylene (74-86-2,25067-58-7)

Guidance literature:

With oxygen; at 376.84 ℃; for 0.000555556h; under 795.08 Torr; Temperature; Inert atmosphere;

DOI:10.1021/jp503772h

Reference yield:

3-hexene (592-47-2) + sulfuric acid (7664-93-9) + water (7732-18-5) → 2,3-diethyloxirane (4468-66-0,36611-93-5,36611-94-6,124718-82-7,135559-58-9,149951-15-5) + n-hexan-3-ol (623-37-0)

Guidance literature:

Reference yield: 94.0%

thiobenzoic acid (98-91-9) + meso-(2R,3S)-2,3-diethyloxirane (36611-94-6) → S-((3R,4R)-4-hydroxyhexan-3-yl) benzothioate

Guidance literature:

With C₅₆H₆₁O₄P; In toluene; at -40 ℃;

DOI:10.1021/ja510069w

upstream raw materials:

3-hexene

sulfuric acid

water

hexane

Downstream raw materials:

n-hexan-3-ol

(1-Ethyl-2-phenylselanyl-butoxy)-trimethyl-silane

(E)-3-(1-ethyl-2-phenylselenenyl-butoxy)-acrylic acid ethyl ester

(3R,4R)-hexane-3,4-diol

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