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116751-24-7

116751-24-7 Structure

116751-24-7 Structure
IdentificationMore
[Name]

3-Hydroxy-2,4,5-trifluorobenzoic acid
[CAS]

116751-24-7
[Synonyms]

2,4,5-TRIFLUORO-3-HYDROXYBENZOIC ACID
3-HYDROXY-2,4,5-TRIFLUOROBENZOIC ACID
2,4,5-Trifluoro-3-Hydroxybenzo
3-Hydroxy-2,4,5-trifluorobenzoic acid ,98%
[Molecular Formula]

C7H3F3O3
[MDL Number]

MFCD00800378
[Molecular Weight]

192.09
[MOL File]

116751-24-7.mol
Questions And AnswerBack Directory
[Synthesis]

3-Hydroxy-2,4,5-trifluorobenzoic acid was synthesized from m-aminobenzoic acid via a three-step reaction involving halogenation, diazotization, and hydrolysis. The synthetic route is shown in the figure below.

Synthesis of 116751-24-7

Figure 1 Synthetic route of 3-Hydroxy-2,4,5-trifluorobenzoic acid

Chemical PropertiesBack Directory
[Appearance]

white to light yellow crystal powder
[Melting point ]

143-147 °C(lit.)
[Boiling point ]

292.6±40.0 °C(Predicted)
[density ]

1.699±0.06 g/cm3(Predicted)
[storage temp. ]

2-8°C, stored under nitrogen
[solubility ]

soluble in Methanol
[form ]

powder to crystal
[pka]

2.75±0.10(Predicted)
[color ]

White to Almost white
[Detection Methods]

HPLC,NMR
[InChI]

InChI=1S/C7H3F3O3/c8-3-1-2(7(12)13)4(9)6(11)5(3)10/h1,11H,(H,12,13)
[InChIKey]

YYAFUGSJSHXYNK-UHFFFAOYSA-N
[SMILES]

C(O)(=O)C1=CC(F)=C(F)C(O)=C1F
[CAS DataBase Reference]

116751-24-7(CAS DataBase Reference)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P264-P271-P280-P302+P352-P305+P351+P338
[Hazard Codes ]

Xi
[Risk Statements ]

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

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
S37/39:Wear suitable gloves and eye/face protection .
[WGK Germany ]

3
[Hazard Note ]

Irritant
[HazardClass ]

IRRITANT
[HS Code ]

29182900
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[Chemical Properties]

white to light yellow crystal powder
[Uses]

2,4,5-Trifluoro-3-hydroxybenzoic Acid can be used to prepare quinoline derivatives as Antibacterial Agents.
Spectrum DetailBack Directory
[Spectrum Detail]

3-Hydroxy-2,4,5-trifluorobenzoic acid(116751-24-7)1HNMR
3-Hydroxy-2,4,5-trifluorobenzoic acid(116751-24-7)IR
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

3-Hydroxy-2,4,5-trifluorobenzoic acid, 98%(116751-24-7)
[Sigma Aldrich]

116751-24-7(sigmaaldrich)
[TCI AMERICA]

2,4,5-Trifluoro-3-hydroxybenzoic Acid,>98.0%(GC)(T)(116751-24-7)
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