ChemicalBook--->CAS DataBase List--->85118-02-1

85118-02-1

85118-02-1 Structure

85118-02-1 Structure
IdentificationMore
[Name]

2,4-DIFLUOROBENZAMIDE
[CAS]

85118-02-1
[Synonyms]

2,4-DIFLUOROBENZAMIDE
DIFLUORO BENZAMIDE
Benzamide, 2,4-difluoro-
2,4-Difluorobenzamide 99%
2,4-Difluorobenzamide99%
[EINECS(EC#)]

285-654-7
[Molecular Formula]

C7H5F2NO
[MDL Number]

MFCD00015547
[Molecular Weight]

157.12
[MOL File]

85118-02-1.mol
Chemical PropertiesBack Directory
[Appearance]

white to light yellow crystal powde
[Melting point ]

161-165 °C (lit.)
[Boiling point ]

200.4±30.0℃ (760 Torr)
[density ]

1.348±0.06 g/cm3 (20 ºC 760 Torr)
[Fp ]

75.0±24.6℃
[storage temp. ]

Sealed in dry,Room Temperature
[form ]

solid
[pka]

15.19±0.50(Predicted)
[InChI]

1S/C7H5F2NO/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3H,(H2,10,11)
[InChIKey]

KTXFXDMDYZIXSJ-UHFFFAOYSA-N
[SMILES]

NC(=O)c1ccc(F)cc1F
[CAS DataBase Reference]

85118-02-1(CAS DataBase Reference)
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:Wear suitable protective clothing and gloves .
[WGK Germany ]

3
[Hazard Note ]

Irritant
[HazardClass ]

IRRITANT
[HS Code ]

2924297099
[Storage Class]

11 - Combustible Solids
Hazard InformationBack Directory
[Chemical Properties]

white to light yellow crystal powde
[Synthesis]

2,4-Difluorobenzoyl chloride

72482-64-5

2,4-DIFLUOROBENZAMIDE

85118-02-1

General procedure for the synthesis of 2,4-difluorobenzamide from 2,4-difluorobenzoyl chloride: in a 250 mL three-necked flask, 150 mL of ammonia was added and cooled down to -10°C. The concentrate of 2,4-difluorobenzoyl chloride was added slowly dropwise, and the reaction was kept incubated for 0.5 h at -10°C, and then brought up to room temperature and continued for 1 h. The reaction was completed by filtration. After completion of the reaction, the product was separated by filtration and the filter cake was dried under vacuum to give 23.8 g of 2,4-difluorobenzamide in 95.5% yield.

[References]

[1] Patent: CN106854165, 2017, A. Location in patent: Paragraph 0102; 0103; 0134; 0135
Spectrum DetailBack Directory
[Spectrum Detail]

2,4-DIFLUOROBENZAMIDE(85118-02-1)1HNMR
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

2,4-Difluorobenzamide, 97%(85118-02-1)
[Sigma Aldrich]

85118-02-1(sigmaaldrich)
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