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Hydrochloric Acid → N-[4-(2-cyanoethyl)cyclohexyl]-N-cyclopropyl-4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)benzamide

HRID 834267
Notes
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Reaction equation

HRID 834267 reaction equation
[CH:51]([N:52]([CH2:53][CH3:54])[CH:55]([CH3:56])[CH3:57])([CH3:58])[CH3:59].[CH:60]1([NH:63][CH:64]2[CH2:65][CH2:66][CH:67]([CH2:70][CH2:71][C:72]#[N:73])[CH2:68][CH2:69]2)[CH2:61][CH2:62]1.[ClH:74].[F:1][C:2]([C:3]([CH3:4])([OH:5])[c:6]1[cH:7][cH:8][c:9]([C:10](=[O:11])[OH:12])[cH:13][cH:14]1)([F:15])[F:16].[O:75]=[CH:76][N:77]([CH3:78])[CH3:79].[OH:41][n:42]1[c:43]2[c:44]([cH:45][cH:46][cH:47][cH:48]2)[n:49][n:50]1.[P-:17]([F:18])([F:19])([F:20])([F:21])([F:22])[F:23].[n:24]1([O:25][C:26]([N:27]([CH3:28])[CH3:29])=[N+:30]([CH3:31])[CH3:32])[c:33]2[cH:34][cH:35][cH:36][cH:37][c:38]2[n:39][n:40]1>>[F:1][C:2]([C:3]([CH3:4])([OH:5])[c:6]1[cH:7][cH:8][c:9]([C:10](=[O:12])[N:63]([CH:60]2[CH2:61][CH2:62]2)[CH:64]2[CH2:65][CH2:66][CH:67]([CH2:70][CH2:71][C:72]#[N:73])[CH2:68][CH2:69]2)[cH:13][cH:14]1)([F:15])[F:16]
ParticipantsSources & evidenceReaction notes

Participants

9

Reactant 8

HCID 313Hydrochloric AcidHCID 6228DimethylformamideHCID 9886HexafluorophosphateHCID 757711-HydroxybenzotriazoleHCID 81531DiisopropylethylamineHCID 130500O-benzotriazol-1-yl-tetramethyluroniumHCID 57892527
4-(1,1,1-Trifluoro-2-hydroxypropan-2-yl)benzoic acid
HCID 578925433-(4-(Cyclopropylamino)cyclohexyl)propanenitrile

Product 1

HCID 56677340N-[4-(2-cyanoethyl)cyclohexyl]-N-cyclopropyl-4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)benzamide

Sources & evidence

ORD record
ord-aa2e13c34d1541daa12a353496182777
Source dataset
Test data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes