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115035-43-3

115035-43-3 Structure

115035-43-3 Structure
IdentificationBack Directory
[Name]

3-BROMO-2-COUMARANONE
[CAS]

115035-43-3
[Synonyms]

3-Brom-2-cumaranon
3-BROMO-2-COUMARANONE
3-Bromo-2-coumaranone 95%
3-Bromobenzofuran-2(3H)-one
2(3H)-Benzofuranone,3-bromo-
3-bromo-3H-1-benzofuran-2-one
[Molecular Formula]

C8H5BrO2
[MDL Number]

MFCD00012320
[MOL File]

115035-43-3.mol
[Molecular Weight]

213.03
Chemical PropertiesBack Directory
[Melting point ]

107-109 °C(lit.)
[Boiling point ]

236.5±39.0 °C(Predicted)
[density ]

1.768±0.06 g/cm3(Predicted)
[storage temp. ]

2-8°C
[solubility ]

ethyl acetate: soluble25mg/mL, clear, colorless to yellow
[InChI]

1S/C8H5BrO2/c9-7-5-3-1-2-4-6(5)11-8(7)10/h1-4,7H
[InChIKey]

MXSVEBOOHMKMQG-UHFFFAOYSA-N
[SMILES]

BrC1C(=O)Oc2ccccc12
Safety DataBack Directory
[WGK Germany ]

3
[Storage Class]

11 - Combustible Solids
Hazard InformationBack Directory
[Uses]

3-Bromo-2-coumaranone has been tested for allergenicity by murine local lymph-node assay.
[General Description]

3-Bromo-2-coumaranone has been tested for allergenicity by murine local lymph-node assay.
Spectrum DetailBack Directory
[Spectrum Detail]

3-BROMO-2-COUMARANONE(115035-43-3)1HNMR
3-BROMO-2-COUMARANONE(115035-43-3)Raman
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