| Identification | More | [Name]
alpha,alpha,alpha-Trifluoro-o-toluoyl chloride | [CAS]
329-15-7 | [Synonyms]
4-(TRIFLUORMETHYL)-BENZOYL CHLORIDE 4-(TRIFLUOROMETHYL)BENZOYL CHLORIDE ALPHA,ALPHA,ALPHA-TRIFLUORO-P-TOLUOYL CHLORIDE PTF-BOC P-TRIFLUOROMETHYLBENZOYL CHLORIDE TIMTEC-BB SBB003467 4-(trifluoromethyl)-benzoylchlorid Benzoyl chloride, 4-(trifluoromethyl)- p-Toluoyl chloride, alpha,alpha,alpha-trifluoro- p-Trifluoromethyl benzoic acid chloride 4-(TrifluoromethylbenzoylChloride/P-(TrifluoromethylbenzoylChloride à,à,à-trifluoro-p-toluoyl chloride α,α,α-trifluoro-p-toluoyl chloride 4-(Trifluoromethyl)benzoylchloride97% alpha,alpha,alpha-Trifluoro-o-toluoyl chloride 4-(Trifluoromethyl)benzoyl chloride ,98% 4-(Trifluoromethyl)benzoic acid chloride | [EINECS(EC#)]
206-342-9 | [Molecular Formula]
C8H4ClF3O | [MDL Number]
MFCD00000694 | [Molecular Weight]
208.56 | [MOL File]
329-15-7.mol |
| Chemical Properties | Back Directory | [Appearance]
clear colourless to yellow liquid | [Melting point ]
-3°C | [Boiling point ]
188-190 °C(lit.) | [density ]
1.404 g/mL at 25 °C(lit.)
| [refractive index ]
n20/D 1.476(lit.)
| [Fp ]
173 °F
| [storage temp. ]
Inert atmosphere,2-8°C | [form ]
Liquid | [color ]
Clear colorless to yellow | [Specific Gravity]
1.404 | [Water Solubility ]
decomposes | [Sensitive ]
Lachrymatory | [Detection Methods]
GC,NMR | [BRN ]
391282 | [InChI]
1S/C8H4ClF3O/c9-7(13)5-1-3-6(4-2-5)8(10,11)12/h1-4H | [InChIKey]
OXZYBOLWRXENKT-UHFFFAOYSA-N | [SMILES]
FC(F)(F)c1ccc(cc1)C(Cl)=O | [CAS DataBase Reference]
329-15-7(CAS DataBase Reference) | [NIST Chemistry Reference]
4-(Trifluoromethyl)benzoyl chloride(329-15-7) | [Storage Precautions]
Moisture sensitive;Store under nitrogen | [EPA Substance Registry System]
329-15-7(EPA Substance) |
| Safety Data | Back Directory | [Hazard Codes ]
C | [Risk Statements ]
R34:Causes burns. R29:Contact with water liberates toxic gas. | [Safety Statements ]
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice . S36/37/39:Wear suitable protective clothing, gloves and eye/face protection . S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) . S8:Keep container dry . | [RIDADR ]
UN 3265 8/PG 2
| [WGK Germany ]
3
| [F ]
10-19-21 | [Hazard Note ]
Corrosive/Lachrymatory | [TSCA ]
T | [HazardClass ]
8 | [PackingGroup ]
II | [HS Code ]
29163900 | [Storage Class]
8A - Combustible corrosive hazardous materials | [Hazard Classifications]
Eye Dam. 1 Skin Corr. 1B |
| Hazard Information | Back Directory | [Chemical Properties]
clear colourless to yellow liquid | [Uses]
4-(Trifluoromethyl)benzoyl chloride is an important raw material and intermediate used in Organic Synthesis, Pharmaceuticals, Agrochemicals and Dyestuff. | [General Description]
4-(Trifluoromethyl)benzoyl chloride undergoes microwave-promoted Suzuki-type coupling reaction with phenylboronic acid to yield 4-(trifluoromethyl)benzophenone. |
| Spectrum Detail | Back Directory | [Spectrum Detail]
alpha,alpha,alpha-Trifluoro-o-toluoyl chloride(329-15-7)MS alpha,alpha,alpha-Trifluoro-o-toluoyl chloride(329-15-7)1HNMR alpha,alpha,alpha-Trifluoro-o-toluoyl chloride(329-15-7)13CNMR alpha,alpha,alpha-Trifluoro-o-toluoyl chloride(329-15-7)IR1 alpha,alpha,alpha-Trifluoro-o-toluoyl chloride(329-15-7)Raman
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