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822-85-5

822-85-5 Structure

822-85-5 Structure
IdentificationBack Directory
[Name]

2-BROMO-CYCLOHEXANONE
[CAS]

822-85-5
[Synonyms]

2-BROMO-CYCLOHEXANONE
2-bromo-1-cyclohexanone
Cyclohexanone, 2-bromo-
2-broMocyclohexan-1-one
2-Bromocyclohexanone,>98%
2-Bromocyclohexanone (±)-form
2-BroMocyclohexanone >=90% (GC)
2-BROMO-CYCLOHEXANONE 95 % GC, 95%
2-Bromocyclohexan-1-one (stabilized with HQ + CaCO3)
[Molecular Formula]

C6H9BrO
[MDL Number]

MFCD09033417
[MOL File]

822-85-5.mol
[Molecular Weight]

177.04
Chemical PropertiesBack Directory
[Boiling point ]

89-90 °C(Press: 14 Torr)
[density ]

1.3400
[refractive index ]

1.516
[storage temp. ]

-20°C
[form ]

liquid
[Appearance]

Colorless to light yellow Liquid
[BRN ]

1071730
[InChI]

InChI=1S/C6H9BrO/c7-5-3-1-2-4-6(5)8/h5H,1-4H2
[InChIKey]

KDXYEWRAWRZXFT-UHFFFAOYSA-N
[SMILES]

C1(=O)CCCCC1Br
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H317-H319-H335
[Precautionary statements ]

P280-P302+P352-P305+P351+P338
[Hazard Codes ]

Xi
[Risk Statements ]

36/37/38-43
[Safety Statements ]

26-36/37
[RIDADR ]

UN 3334
[WGK Germany ]

3
[HS Code ]

2914790090
[Storage Class]

10 - Combustible liquids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
Skin Sens. 1
STOT SE 3
Hazard InformationBack Directory
[Synthesis Reference(s)]

Journal of the American Chemical Society, 90, p. 6218, 1968 DOI: 10.1021/ja01024a051
Tetrahedron Letters, 20, p. 3653, 1979 DOI: 10.1016/S0040-4039(01)95488-7
Spectrum DetailBack Directory
[Spectrum Detail]

2-BROMO-CYCLOHEXANONE(822-85-5)1HNMR
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