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1218935-60-4

1218935-60-4 Structure

1218935-60-4 Structure
IdentificationBack Directory
[Name]

(R)-2-(2,5-DIFLUOROPHENYL)PYRROLIDINE HYDROCHLORIDE
[CAS]

1218935-60-4
[Synonyms]

(R)-2-(2,5-DIFLUOROPHENYL)PYRROLIDINE HCL
(R)-2-(2,5-Difluorophenyl)pyrrolidene hydrochloride
(R)-2-(2,5-DIFLUOROPHENYL)PYRROLIDINE HYDROCHLORIDE
Pyrrolidine, 2-(2,5-difluorophenyl)-, hydrochloride (1:1), (2R)-
[EINECS(EC#)]

-0
[Molecular Formula]

C10H12ClF2N
[MDL Number]

MFCD08751413
[MOL File]

1218935-60-4.mol
[Molecular Weight]

219.66
Chemical PropertiesBack Directory
[storage temp. ]

Sealed in dry,Room Temperature
[Appearance]

Off-white to light yellow Solid
[InChI]

InChI=1/C10H11F2N.ClH/c11-7-3-4-9(12)8(6-7)10-2-1-5-13-10;/h3-4,6,10,13H,1-2,5H2;1H/t10-;/s3
[InChIKey]

XSWCQOVADZHFIJ-MEQOOBBNNA-N
[SMILES]

FC1C=CC(F)=CC=1[C@@H]1NCCC1.Cl |&1:8,r|
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
[HS Code ]

2933998090
Spectrum DetailBack Directory
[Spectrum Detail]

(R)-2-(2,5-DIFLUOROPHENYL)PYRROLIDINE HYDROCHLORIDE(1218935-60-4)1HNMR
Hazard InformationBack Directory
[Synthesis]

Pyrrolidine, 2-(2,5-difluorophenyl)-1-[(S)-(1,1-dimethylethyl)sulfinyl]-, (2R)-

1443538-31-5

(R)-2-(2,5-DIFLUOROPHENYL)PYRROLIDINE HYDROCHLORIDE

1218935-60-4

The general procedure for the synthesis of (R)-2-(2,5-difluorophenyl)pyrrolidine hydrochloride from the compound (CAS: 1443538-31-5) was as follows: to a stirred solution of (R)-1-((S)-tert-butylsulfinyl)-2-(2,5-difluorophenyl)pyrrolidine (15 g, 52.19 mmol) in dioxane (25 mL) was added a 4 M HCl to a solution of dioxane (75 mL). The reaction mixture was stirred continuously at 20-35°C for 4 hours. Upon completion of the reaction, the mixture was concentrated under reduced pressure to give the crude product. The crude product was purified by washing with ether to give 7.5 g of (R)-2-(2,5-difluorophenyl)pyrrolidine hydrochloride as a white solid. Mass spectrometry (ESI) analysis showed: m/z 184 (M + H).

[References]

[1] Patent: WO2013/88256, 2013, A1. Location in patent: Page/Page column 59
[2] Patent: US2014/371217, 2014, A1. Location in patent: Paragraph 0561
[3] Patent: US2015/5280, 2015, A1. Location in patent: Paragraph 0527 - 0529
[4] Patent: US2015/368238, 2015, A1. Location in patent: Paragraph 0574; 0579
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