ChemicalBook--->CAS DataBase List--->426844-51-1

426844-51-1

426844-51-1 Structure

426844-51-1 Structure
IdentificationBack Directory
[Name]

4,4-DIFLUORO-L-PROLINAMIDE HYDROCHLORIDE
[CAS]

426844-51-1
[Synonyms]

4,4-Difluoro-l-prolinaMide, HCl
4,4-DIFLUORO-L-PROLINAMIDE HYDROCHLORIDE
(2S)-4,4-difluoropyrrolidine-2-carboxamide
(S)-4,4-difluoropyrrolidine-2-carboxamide HCl
(2S)-4,4-difluoro-2-pyrrolidinecarboxamide, HCl
-4,4-Difluoropyrrolidine-2-carboxamide hydrochloride
(S)-4,4-difluoropyrrolidine-2-carboxamide hydrochloride
(2S)-4,4-difluoropyrrolidine-2-carboxamide hydrochloride
[Molecular Formula]

C5H9ClF2N2O
[MDL Number]

MFCD06797014
[MOL File]

426844-51-1.mol
[Molecular Weight]

186.59
Chemical PropertiesBack Directory
[Melting point ]

222°C
[storage temp. ]

Inert atmosphere,Room Temperature
[solubility ]

DMSO (Slightly), Methanol (Slightly)
[form ]

Solid
[color ]

Pale Grey to Light Grey
[Optical Rotation]

[α]/D 23±5°, c = 0.5 in H2O
[InChI]

InChI=1/C5H8F2N2O.ClH/c6-5(7)1-3(4(8)10)9-2-5;/h3,9H,1-2H2,(H2,8,10);1H/t3-;/s3
[InChIKey]

RRQDQYAEZGKHOB-OQFXAWDINA-N
[SMILES]

C1[C@@H](C(N)=O)NCC1(F)F.Cl |&1:1,r|
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P264-P271-P280-P302+P352-P305+P351+P338
[Hazard Codes ]

Xi
[Risk Statements ]

36/37/38
[Safety Statements ]

26
[WGK Germany ]

3
[HS Code ]

2933998090
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[Uses]

4,4-Difluoro-L-prolinamide hydrochloride can be used as a building block in the synthesis of cyanopyrrolidine based DPP-IV inhibitors.
Spectrum DetailBack Directory
[Spectrum Detail]

4,4-DIFLUORO-L-PROLINAMIDE HYDROCHLORIDE(426844-51-1)1HNMR
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