1,2-Epoxyhexane

Base Information

• Chemical Name: 1,2-Epoxyhexane
• CAS No.: 1436-34-6
• Molecular Formula: C6H12 O
• Molecular Weight: 100.161
• Hs Code.: 29109000
• European Community (EC) Number: 215-864-6
• NSC Number: 246211,24268
• DSSTox Substance ID: DTXSID10870872
• Nikkaji Number: J73.698H
• Wikidata: Q104386482
• Mol file: 1436-34-6.mol

Synonyms:1,2-epoxyhexane

Chemical Property of 1,2-Epoxyhexane

Chemical Property:

• Appearance/Colour: clear colorless liquid
• Vapor Pressure: 21.1mmHg at 25°C
• Melting Point: 94°C
• Refractive Index: n20/D 1.406
• Boiling Point: 117.1°Cat760mmHg
• Flash Point: 21.8°C
• PSA: 12.53000
• Density: 0.871g/cm³
• LogP: 1.57540
• Storage Temp.: 2-8°C
• Solubility.: Difficult to mix.
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 100.088815002
• Heavy Atom Count: 7
• Complexity: 52.1

Purity/Quality:

98% ^*data from raw suppliers

1,2-Epoxyhexane ^*data from reagent suppliers

Safty Information:

• Hazard Codes: F,Xn
• Statements: 11-22-36/37/38
• Safety Statements: 26

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CCCCC1CO1
• Uses: 1,2-Epoxyhexane is used as chemical reagent, organic intermediates, fine chemicals, pharmaceutical research and development.

Technology Process of 1,2-Epoxyhexane

There total 125 articles about 1,2-Epoxyhexane 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: 58.0%

1-hexene (592-41-6,25067-06-5) → 1,2-Epoxyhexane (1436-34-6) + n-hexan-2-ol (626-93-7) + n-hexan-2-one (591-78-6)

Guidance literature:

With iodosylbenzene; (n-Bu₄N)4H(Mn)PW₁₁O₃₉; In acetonitrile; at 24 ℃; for 2h; Product distribution; other reagent, other catalysts, other time;

DOI:10.1021/ja00263a046

Reference yield: 50.0%

1-hexene (592-41-6,25067-06-5) → 1,2-Epoxyhexane (1436-34-6) + rac-2-hydroxyhexanoic acid (636-36-2,6064-63-7) + valeric acid (109-52-4)

Guidance literature:

With [γ-W10SiO36(PhPO)2][TBA]4; dihydrogen peroxide; In acetonitrile; at 90 - 120 ℃; for 0.833333h; microwave irradiation;

DOI:10.1021/ol061197o

Reference yield: 29.0%

1-hexene (592-41-6,25067-06-5) → 1,2-Epoxyhexane (1436-34-6) + 1-hexene-3-ol (4798-44-1,67928-93-2) + 1-hexene-3-one (1629-60-3) + hexanal (66-25-1)

Guidance literature:

With iodosylbenzene; 5,10,15,20-tetraphenyl-21 H,23-H-porphine manganese(III)chloride; In benzene; for 2h; Ambient temperature; anaerobic cond.;

DOI:10.1016/S0040-4020(01)98805-2

upstream raw materials:

1-hexene

6-iodo-1,2-epoxyhexane

1,2-epoxy-2-hexyl(triphenyl)silane

methanol

Downstream raw materials:

Hexane-1,2-diol

1-(phenylthio)-2-hexanol

decan-5-ol

formaldehyd