ChemicalBook--->CAS DataBase List--->105184-38-1

105184-38-1

105184-38-1 Structure

105184-38-1 Structure
IdentificationMore
[Name]

3,5-Difluorophenylacetic acid
[CAS]

105184-38-1
[Synonyms]

2-(3,5-DIFLUOROPHENYL)ACETIC ACID
3,5-DIFLUOROPHENYLACETIC ACID
RARECHEM AL BO 0631
TIMTEC-BB SBB006660
3,5-Difluorophenylacetic acid 99%
3,5-Difluorophenylaceticacid99%
[EINECS(EC#)]

626-119-3
[Molecular Formula]

C8H6F2O2
[MDL Number]

MFCD00010316
[Molecular Weight]

172.13
[MOL File]

105184-38-1.mol
Chemical PropertiesBack Directory
[Appearance]

light yellow crystalline powder
[Melting point ]

68-70 °C (lit.)
[Boiling point ]

219°C (rough estimate)
[density ]

1.3010 (estimate)
[storage temp. ]

Sealed in dry,Room Temperature
[solubility ]

soluble in Methanol
[form ]

powder to crystal
[pka]

3.90±0.10(Predicted)
[color ]

White to Light yellow
[BRN ]

3605064
[InChI]

InChI=1S/C8H6F2O2/c9-6-1-5(3-8(11)12)2-7(10)4-6/h1-2,4H,3H2,(H,11,12)
[InChIKey]

IGGNSAVLXJKCNH-UHFFFAOYSA-N
[SMILES]

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

105184-38-1(CAS DataBase Reference)
Questions And AnswerBack Directory
[Uses]

3,5-Difluorophenylacetic acid is used in the biological study of the inhibition of penicillin biosynthetic enzymes by phenylacetic acid halogen derivatives, preparation and in vitro cytotoxic activities of sorafenib derivatives.
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 .
S36:Wear suitable protective clothing .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S22:Do not breathe dust .
[WGK Germany ]

3
[Hazard Note ]

Irritant
[HazardClass ]

IRRITANT
[HS Code ]

29163990
Raw materials And Preparation ProductsBack Directory
[Raw materials]

N,N-Dimethylformamide-->Sodium hydride-->Malononitrile-->1,3,5-Trifluorobenzene
[Preparation Products]

1-(3,5-DIFLUOROPHENYL)ETHANOL-->(3,5-Difluoro-phenyl)-acetic acid methyl ester-->ethyl 2-(3,5-difluorophenyl)acetate
Hazard InformationBack Directory
[Chemical Properties]

light yellow crystalline powder
[General Description]

3,5-Difluorophenylacetic acid is an important pharmaceutical intermediate.
Spectrum DetailBack Directory
[Spectrum Detail]

3,5-Difluorophenylacetic acid(105184-38-1)1HNMR
3,5-Difluorophenylacetic acid(105184-38-1)IR
3,5-Difluorophenylacetic acid(105184-38-1)Raman
3,5-Difluorophenylacetic acid(105184-38-1)FT-IR
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

3,5-Difluorophenylacetic acid, 99%(105184-38-1)
[Alfa Aesar]

3,5-Difluorophenylacetic acid, 99%(105184-38-1)
[Sigma Aldrich]

105184-38-1(sigmaaldrich)
[TCI AMERICA]

3,5-Difluorophenylacetic Acid,>98.0%(T)(105184-38-1)
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