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312-20-9

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312-20-9 Structure

312-20-9 Structure
IdentificationBack Directory
[Name]

1-Bromo-4-[(trifluoromethyl)sulfonyl]benzene
[CAS]

312-20-9
[Synonyms]

1-bromo-4-trifluoromethanesulfonylbenzene
1-Bromo-4-[(trifluoromethyl)sulfonyl]benzene
Benzene, 1-bromo-4-[(trifluoromethyl)sulfonyl]-
[Molecular Formula]

C7H4BrF3O2S
[MDL Number]

MFCD00474580
[MOL File]

312-20-9.mol
[Molecular Weight]

289.07
Chemical PropertiesBack Directory
[Melting point ]

64-65 °C(Solv: ethanol (64-17-5))
[Boiling point ]

292.0±40.0 °C(Predicted)
[density ]

1.764±0.06 g/cm3(Predicted)
[storage temp. ]

Store at room temperature
[form ]

solid
[Appearance]

White to off-white Solid
[InChI]

InChI=1S/C7H4BrF3O2S/c8-5-1-3-6(4-2-5)14(12,13)7(9,10)11/h1-4H
[InChIKey]

BRNFLBCPGQCBQQ-UHFFFAOYSA-N
[SMILES]

C1(Br)=CC=C(S(C(F)(F)F)(=O)=O)C=C1
Safety DataBack Directory
[WGK Germany ]

WGK 3
[HazardClass ]

IRRITANT
[HS Code ]

2930909899
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Spectrum DetailBack Directory
[Spectrum Detail]

1-Bromo-4-[(trifluoromethyl)sulfonyl]benzene(312-20-9)1HNMR
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