ChemicalBook--->CAS DataBase List--->85068-28-6

85068-28-6

85068-28-6 Structure

85068-28-6 Structure
IdentificationMore
[Name]

2,6-Difluorophenylacetic acid
[CAS]

85068-28-6
[Synonyms]

2,6-DIFLUORO-BENZENE ACETIC ACID
2,6-DIFLUOROPHENYLACETIC ACID
RARECHEM AL BO 0249
TIMTEC-BB SBB006631
Benzeneacetic acid, 2,6-difluoro-
2,6-Difluorophenylacetic acid 97%
2,6-Difluorophenylaceticacid97%
[EINECS(EC#)]

285-289-3
[Molecular Formula]

C8H6F2O2
[MDL Number]

MFCD00010001
[Molecular Weight]

172.13
[MOL File]

85068-28-6.mol
Chemical PropertiesBack Directory
[Appearance]

white crystalline powder
[Melting point ]

100-102 °C (lit.)
[Boiling point ]

219°C (rough estimate)
[density ]

1.3010 (estimate)
[storage temp. ]

Sealed in dry,Room Temperature
[form ]

powder to crystal
[pka]

3.73±0.10(Predicted)
[color ]

White to Almost white
[BRN ]

3650109
[InChI]

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

FUGDCKXBUZFEON-UHFFFAOYSA-N
[SMILES]

C1(CC(O)=O)=C(F)C=CC=C1F
[CAS DataBase Reference]

85068-28-6(CAS DataBase Reference)
[NIST Chemistry Reference]

2,6-Difluorophenylacetic acid(85068-28-6)
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 .
[WGK Germany ]

3
[Hazard Note ]

Irritant
[HazardClass ]

IRRITANT
[HS Code ]

29163900
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

2,6-Difluorophenylacetic acid(85068-28-6).msds
Hazard InformationBack Directory
[Chemical Properties]

white crystalline powder
[Uses]

2,6-Difluorophenylacetic acid has been used in the synthesis of:
  • α-azidoacetophenones
  • N-(2,6-difluorobenzyl)-N′-(1H-5-indazolyl)urea
Spectrum DetailBack Directory
[Spectrum Detail]

2,6-Difluorophenylacetic acid(85068-28-6)MS
2,6-Difluorophenylacetic acid(85068-28-6)1HNMR
2,6-Difluorophenylacetic acid(85068-28-6)13CNMR
2,6-Difluorophenylacetic acid(85068-28-6)IR1
2,6-Difluorophenylacetic acid(85068-28-6)IR2
2,6-Difluorophenylacetic acid(85068-28-6)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

2,6-Difluorophenylacetic acid, 99%(85068-28-6)
[Alfa Aesar]

2,6-Difluorophenylacetic acid, 98%(85068-28-6)
[Sigma Aldrich]

85068-28-6(sigmaaldrich)
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