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ChemicalBook--->CAS DataBase List--->125552-89-8

125552-89-8

125552-89-8 Structure

125552-89-8 Structure
IdentificationMore
[Name]

4-BROMOMETHYLTETRAHYDROPYRAN
[CAS]

125552-89-8
[Synonyms]

4-(BROMOMETHYL)-TETRAHYDRO-2H-PYRAN
4-BROMOMETHYLTETRAHYDROPYRAN
4-(Bromomethyl)tetrahydropyrane
4-(Bromomethyl)tetrahydropyran ,97%
[Molecular Formula]

C6H11BrO
[MDL Number]

MFCD03788561
[Molecular Weight]

179.05
[MOL File]

125552-89-8.mol
Chemical PropertiesBack Directory
[Boiling point ]

88 °C
[density ]

1.359±0.06 g/cm3(Predicted)
[storage temp. ]

Inert atmosphere,Store in freezer, under -20°C
[form ]

liquid
[color ]

Light beige/brown
[Detection Methods]

GC
[InChI]

InChI=1S/C6H11BrO/c7-5-6-1-3-8-4-2-6/h6H,1-5H2
[InChIKey]

LMOOYAKLEOGKJR-UHFFFAOYSA-N
[SMILES]

C1OCCC(CBr)C1
[CAS DataBase Reference]

125552-89-8(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

C
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
R34:Causes burns.
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S23:Do not breathe gas/fumes/vapor/spray (appropriate wording to be specified by the manufacturer) .
[RIDADR ]

3265
[Hazard Note ]

Irritant
[HazardClass ]

8
[PackingGroup ]

[HS Code ]

29339900
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Ethanol-->Hydrochloric acid-->Ethyl acetate-->Diethyl ether-->Tetrahydrofuran-->Sodium-->Potassium hydroxide-->Acetone-->Hexane-->Lithium Aluminum Hydride-->Pyridine-->Diethyl malonate-->Tosyl chloride-->Phosphorus tribromide-->Potassium bromide-->Benzyltriethylammonium chloride-->Tetrahydro-2H-pyran-4-carboxylic acid-->2,2'-Dichlorodiethyl ether
Hazard InformationBack Directory
[Chemical Properties]

Viscous liquid
[Uses]

4-(Bromomethyl)tetrahydropyran is an important organic synthesis intermediate, widely used in the fields of medicine, pesticides and dyes. It can be used to synthesize a variety of biologically active compounds, such as antibacterial agents, anti-tumor drugs, nervous system drugs and fluorescent dyes. In addition, 4-(Bromomethyl)tetrahydropyran can also be used to synthesize organic pigments and functional materials.
[Synthesis]

To a solution of Tetrahydropyran-4-methanol and N-bromobutanimide (NBS) in DCM was added PPh3 at 0°C. The reaction mixture was stirred at room temperature for 1–2h. The resulting mixture was washed with water (20mL) and brine (3×20mL). The organic layer was concentrated and the residue was purified by silica gel flash chromatography (eluting with ethyl acetate in petroleum ether 2–5%) to give 4-(Bromomethyl)tetrahydropyran as a colorless oil.
Spectrum DetailBack Directory
[Spectrum Detail]

4-BROMOMETHYLTETRAHYDROPYRAN(125552-89-8)1HNMR
4-BROMOMETHYLTETRAHYDROPYRAN(125552-89-8)FT-IR
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

4-(Bromomethyl)tetrahydropyran, 97%(125552-89-8)
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