| Identification | More | [Name]
4-Fluoro-3-(trifluoromethyl)benzoic acid | [CAS]
67515-55-3 | [Synonyms]
4-FLUORO-3-(TRIFLUOROMETHYL)BENZOIC ACID
ALPHA,ALPHA,ALPHA,4-TETRAFLUORO-M-TOLUIC ACID
BUTTPARK 29\01-67
RARECHEM AL BO 0636
4-Fluoro-3-trifluoromethylbenz
à,à,à,4-tetrafluoro-m-toluic acid
4-Fluoro-3-(trifluoromethyl)benzoic acid 98%
4-Fluoro-3-(trifluoromethyl)benzoicacid98% | [Molecular Formula]
C8H4F4O2 | [MDL Number]
MFCD00061294 | [Molecular Weight]
208.11 | [MOL File]
67515-55-3.mol |
| Chemical Properties | Back Directory | [Melting point ]
114-116 °C (lit.) | [Boiling point ]
256.9±40.0 °C(Predicted) | [density ]
1.489±0.06 g/cm3(Predicted) | [storage temp. ]
Sealed in dry,Room Temperature | [solubility ]
soluble in Methanol | [form ]
powder to crystal | [pka]
3.71±0.10(Predicted) | [color ]
White to Almost white | [BRN ]
1968716 | [InChI]
InChI=1S/C8H4F4O2/c9-6-2-1-4(7(13)14)3-5(6)8(10,11)12/h1-3H,(H,13,14) | [InChIKey]
WZBPZYCJUADXRS-UHFFFAOYSA-N | [SMILES]
C(O)(=O)C1=CC=C(F)C(C(F)(F)F)=C1 | [CAS DataBase Reference]
67515-55-3(CAS DataBase Reference) | [NIST Chemistry Reference]
4-Fluoro-3-(trifluomethyl)benzoic acid(67515-55-3) |
| Safety Data | Back Directory | [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 ]
29163990 | [Storage Class]
11 - Combustible Solids | [Hazard Classifications]
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3 |
| Hazard Information | Back Directory | [Chemical Properties]
White powder | [Uses]
In the field of chemical synthesis, 4-fluoro-3-(trifluoromethyl)benzoic acid is often used as a synthetic intermediate for the preparation of organometallic complexes and active pharmaceutical ingredients (APIs). |
|
|