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881189-58-8

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881189-58-8 Structure

881189-58-8 Structure
IdentificationBack Directory
[Name]

3-(5-Bromo-2-fluorophenyl)propionic acid
[CAS]

881189-58-8
[Synonyms]

3-(5-Bromo-2-fluorophenyl)propionic acid
3-(5-Bromo-2-fluorophenyl)propanoic acid
Benzenepropanoic acid, 5-bromo-2-fluoro-
[Molecular Formula]

C9H8BrFO2
[MDL Number]

MFCD11036289
[MOL File]

881189-58-8.mol
[Molecular Weight]

247.06
Chemical PropertiesBack Directory
[Boiling point ]

330.8±27.0 °C(Predicted)
[density ]

1.606±0.06 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,Room Temperature
[form ]

solid
[pka]

4.57±0.10(Predicted)
[Appearance]

White to off-white Solid
[InChI]

1S/C9H8BrFO2/c10-7-2-3-8(11)6(5-7)1-4-9(12)13/h2-3,5H,1,4H2,(H,12,13)
[InChIKey]

PLZWWEAGJMHRRA-UHFFFAOYSA-N
[SMILES]

OC(CCC1=CC(Br)=CC=C1F)=O
Safety DataBack Directory
[Hazard Codes ]

Xn
[Risk Statements ]

22-36
[Safety Statements ]

26
[WGK Germany ]

3
[REACH Registrations]

Active
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Eye Irrit. 2
Spectrum DetailBack Directory
[Spectrum Detail]

3-(5-Bromo-2-fluorophenyl)propionic acid(881189-58-8)1HNMR
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