ChemicalBook--->CAS DataBase List--->32857-62-8

32857-62-8

32857-62-8 Structure

32857-62-8 Structure
IdentificationMore
[Name]

4-(Trifluoromethyl)phenylacetic acid
[CAS]

32857-62-8
[Synonyms]

2-(4-(TRIFLUOROMETHYL)PHENYL)ACETIC ACID
4-(TRIFLUOROMETHYL)PHENYLACETIC ACID
AKOS BBS-00006832
(ALPHA,ALPHA,ALPHA-TRIFLUORO-P-TOLYL)ACETIC ACID
P-(TRIFLUOROMETHYL)PHENYLACETIC ACID
RARECHEM AL BO 0136
TIMTEC-BB SBB000434
Benzeneacetic acid, 4-(trifluoromethyl)-
(α,α,α-Trifluoro-p-tolyl)acetic acid
(alpha,alpha,alpha-trifluoro-4-tolyl)acetic acid
4-(Trifluoromethyl)Phenylaceti
(à,à,à-trifluoro-p-tolyl)acetic acid
4-(Trifluoromethyl)phenylacetic acid 98%
4-(Trifluoromethyl)phenylaceticacid98%
(A,A,A-TRIFLUORO-P-TOLY)ACETIC ACID
4-(Trifluoromethyl)benzeneacetic acid
[EINECS(EC#)]

251-263-5
[Molecular Formula]

C9H7F3O2
[MDL Number]

MFCD00004352
[Molecular Weight]

204.15
[MOL File]

32857-62-8.mol
Chemical PropertiesBack Directory
[Appearance]

white to very pale yellow crystals or
[Melting point ]

82-85 °C(lit.)
[Boiling point ]

203°C (rough estimate)
[density ]

1.2815 (estimate)
[storage temp. ]

Sealed in dry,Room Temperature
[form ]

Crystals or Crystalline Powder
[pka]

4.01±0.10(Predicted)
[color ]

White to very pale yellow
[BRN ]

2267687
[InChI]

1S/C9H7F3O2/c10-9(11,12)7-3-1-6(2-4-7)5-8(13)14/h1-4H,5H2,(H,13,14)
[InChIKey]

HNORVZDAANCHAY-UHFFFAOYSA-N
[SMILES]

OC(=O)Cc1ccc(cc1)C(F)(F)F
[CAS DataBase Reference]

32857-62-8(CAS DataBase Reference)
[NIST Chemistry Reference]

(«ALPHA»,«alpha»,«alpha»-trifluoro-p-tolyl)-acetic acid(32857-62-8)
Safety DataBack 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 .
S37/39:Wear suitable gloves and eye/face protection .
S36:Wear suitable protective clothing .
[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
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Ethanol-->Sodium hydroxide-->Ethyl acetate-->Tetrahydrofuran-->Dichloromethane-->Petroleum ether-->Magnesium-->4-(Trifluoromethoxy)benzyl bromide
[Preparation Products]

2-Nitro-4-(trifluoromethyl)phenylacetic acid-->1-[4-(Trifluoromethyl)phenyl]butan-2-one-->2-fluoro-2-[4-(trifluoromethyl)phenyl]acetic acid
Hazard InformationBack Directory
[Chemical Properties]

white to very pale yellow crystals or
[Uses]

4-(Trifluoromethyl)benzeneacetic Acid is an intermediate used to synthesize PPARγ/δ dual agonists via solid-Phase parallel synthesis. It was also used to prepare heterocyclic xanthine derivatives as highly potent and selective human A2B adenosine receptor antagonists.
[General Description]

4-(Trifluoromethyl)phenylacetic acid undergoes diolefination mediated by mono-N-protected amino acid ligands in the presence of ethyl acrylate, Pd(OAc)2, KHCO3 and t-amyl alcohol.
Spectrum DetailBack Directory
[Spectrum Detail]

4-(Trifluoromethyl)phenylacetic acid(32857-62-8)MS
4-(Trifluoromethyl)phenylacetic acid(32857-62-8)1HNMR
4-(Trifluoromethyl)phenylacetic acid(32857-62-8)13CNMR
4-(Trifluoromethyl)phenylacetic acid(32857-62-8)IR1
4-(Trifluoromethyl)phenylacetic acid(32857-62-8)IR2
4-(Trifluoromethyl)phenylacetic acid(32857-62-8)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

(alpha,alpha,alpha-Trifluoro-p-tolyl)acetic acid, 98%(32857-62-8)
[Alfa Aesar]

4-(Trifluoromethyl)phenylacetic acid, 99%(32857-62-8)
[Sigma Aldrich]

32857-62-8(sigmaaldrich)
[TCI AMERICA]

4-(Trifluoromethyl)phenylacetic Acid,>96.0%(T)(32857-62-8)
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