ChemicalBook--->CAS DataBase List--->331-25-9

331-25-9

331-25-9 Structure

331-25-9 Structure
IdentificationMore
[Name]

3-Fluorophenylacetic acid
[CAS]

331-25-9
[Synonyms]

3-FLUOROPHENYLACETIC ACID
M-FLUOROPHENYLACETIC ACID
RARECHEM AL BO 0121
3-fluoro-benzeneaceticaci
3-Fluorophenlacetic acid
Acetic acid, (m-fluorophenyl)-
Benzeneacetic acid, 3-fluoro-
3-Fluorophenylacetic acid, 97+%
3-Fluorophenylacetic acid 98%
3-Fluorophenylaceticacid98%
3-fluoro-benzeneacetic acid
2-(3-Fluorophenyl)acetic Acid
[EINECS(EC#)]

206-360-7
[Molecular Formula]

C8H7FO2
[MDL Number]

MFCD00004331
[Molecular Weight]

154.14
[MOL File]

331-25-9.mol
Chemical PropertiesBack Directory
[Appearance]

White to pale yellow or light beige crystalline
[Melting point ]

42-44 °C (lit.)
[Boiling point ]

151 °C
[density ]

1.1850 (estimate)
[Fp ]

>230 °F
[storage temp. ]

Sealed in dry,Room Temperature
[form ]

powder to crystal
[pka]

4.10±0.10(Predicted)
[color ]

White to Almost white
[Water Solubility ]

Slightly soluble in chloroform and methanol. Insoluble in water.
[BRN ]

775898
[InChI]

InChI=1S/C8H7FO2/c9-7-3-1-2-6(4-7)5-8(10)11/h1-4H,5H2,(H,10,11)
[InChIKey]

YEAUYVGUXSZCFI-UHFFFAOYSA-N
[SMILES]

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

331-25-9(CAS DataBase Reference)
[NIST Chemistry Reference]

M-fluorophenylacetic acid(331-25-9)
[EPA Substance Registry System]

331-25-9(EPA Substance)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P280g-P305+P351+P338
[Hazard Codes ]

Xi
[Risk Statements ]

R38:Irritating to the skin.
R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S22:Do not breathe dust .
S24/25:Avoid contact with skin and eyes .
S36:Wear suitable protective clothing .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
[WGK Germany ]

3
[Hazard Note ]

Irritant
[TSCA ]

T
[HazardClass ]

IRRITANT
[HS Code ]

29163900
[Storage Class]

13 - Non Combustible Solids
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

3-Fluorophenylacetic acid(331-25-9).msds
Hazard InformationBack Directory
[Chemical Properties]

White to pale yellow or light beige crystalline
[Uses]

3-Fluorophenylacetic acid has been used as building block to synthesize the pentaamine and bis-heterocyclic libraries. It is also used as a medicine intermediates.
[Synthesis]

Preparation of m-fluorophenylacetic acid: 350 g of 32% HCl and 250 g of 3-fluoroaniline were added to the reaction flask, heated and stirred until dissolved clear. Cool down to -5 to 5 ℃, 20 g tetramethyl ammonium chloride and 20 g copper chloride. Ace

Spectrum DetailBack Directory
[Spectrum Detail]

3-Fluorophenylacetic acid(331-25-9)MS
3-Fluorophenylacetic acid(331-25-9)1HNMR
3-Fluorophenylacetic acid(331-25-9)IR1
3-Fluorophenylacetic acid(331-25-9)IR2
3-Fluorophenylacetic acid(331-25-9)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

3-Fluorophenylacetic acid, 98%(331-25-9)
[Alfa Aesar]

3-Fluorophenylacetic acid, 98%(331-25-9)
[Sigma Aldrich]

331-25-9(sigmaaldrich)
[TCI AMERICA]

3-Fluorophenylacetic Acid,>98.0%(GC)(331-25-9)
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