Tetrahydro-2H-pyran-2-methanol acetate

Base Information

• Chemical Name: Tetrahydro-2H-pyran-2-methanol acetate
• CAS No.: 5440-83-5
• Molecular Formula: C8H14O3
• Molecular Weight: 158.195
• European Community (EC) Number: 226-625-0
• NSC Number: 44985,20751
• DSSTox Substance ID: DTXSID10884156
• Nikkaji Number: J210.477F
• Mol file: 5440-83-5.mol

Synonyms:Tetrahydro-2H-pyran-2-methanol acetate;5440-83-5;NSC 20751;Tetrahydro-2H-pyran-2-methyl acetate;2H-Pyran-2-methanol, tetrahydro-, acetate;2H-Pyran-2-methanol, tetrahydro-, 2-acetate;EINECS 226-625-0;NSC 44985;AI3-21178;oxan-2-ylmethyl acetate;SCHEMBL14677008;DTXSID10884156;NSC20751;NSC44985;NSC-20751;NSC-44985;AKOS024332426;TETRAHYDROPYRAN-2-YLMETHYL ACETATE

Chemical Property of Tetrahydro-2H-pyran-2-methanol acetate

Chemical Property:

• Vapor Pressure: 0.133mmHg at 25°C
• Boiling Point: 217.4°Cat760mmHg
• Flash Point: 93.1°C
• Density: 1.02g/cm³
• XLogP3: 0.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 158.094294304
• Heavy Atom Count: 11
• Complexity: 133

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)OCC1CCCCO1

Technology Process of Tetrahydro-2H-pyran-2-methanol acetate

There total 6 articles about Tetrahydro-2H-pyran-2-methanol acetate 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: 96.0%

Tetrahydropyran-2-methanol (100-72-1) + acetic acid (64-19-7,77671-22-8) → oxane-2-yl-methyl acetate (5440-83-5,116779-14-7)

Guidance literature:

scandium tris(trifluoromethanesulfonate); for 24h; Ambient temperature;

DOI:10.1039/a606484a

Reference yield: 96.0%

5-Hexen-1-ol (821-41-0) + thallium(III) triacetate (2570-63-0) → oxane-2-yl-methyl acetate (5440-83-5,116779-14-7)

Guidance literature:

In benzene; Heating;

Reference yield: 57.0%

Trimethyl orthoacetate (1445-45-0) + hexane-1,2,6-triol (106-69-4,112254-74-7) → oxane-2-yl-methyl acetate (5440-83-5,116779-14-7)

Guidance literature:

With trimethylsilyl trifluoromethanesulfonate; In dichloromethane; at 0 ℃; for 2h;

upstream raw materials:

Tetrahydropyran-2-methanol

acetic anhydride

Trimethyl orthoacetate

hexane-1,2,6-triol

Downstream raw materials:

perfluoro(2-methyl-1,3,5-trioxaspiro[4.5]decane)

perfluorooxane

perfluoro(2-methyloxane)

perfluoro(2-ethyltetrahydrofuran)

Refernces

• 1、 Abe, Takashi,Tamura, Masanori,Sekiya, Akira. "Electrochemical fluorination of several esters derived from oxolane-2-yl-carboxylic acid, oxolane-2-yl-methanol and oxane-2-yl-methanol". . p. 325 - 332. Retrieved 2007/10/03.
• 2、 Fujioka, Hiromichi,Kitagawa, Hidetoshi,Kondo, Michinori,Matsunaga, Naoki,Kitagaki, Shinji,Kita, Yasuyuki. "REACTION OF DIOLS AND TRIOLS WITH TRIALKYL ORTHOESTERS: FACILE ONE-POT FORMATION OF OXACYCLIC COMPOUNDS FROM TRIOLS". . p. 665 - 669. Retrieved 2007/10/02.