Water → Ethyl 2-(3-(benzo[c][1,2,5]oxadiazol-5-yl)-5-chloro-4-(cyclopropylmethoxy)phenyl)-4-methylpentanoate

HRID 932356Notes

Reaction equation

HRID 932356 reaction equation
[Br:1][c:2]1[cH:3][c:4]([CH:14]([C:15](=[O:16])[O:17][CH2:18][CH3:19])[CH2:20][CH:21]([CH3:22])[CH3:23])[cH:5][c:6]([Cl:13])[c:7]1[O:8][CH2:9][CH:10]1[CH2:11][CH2:12]1.[C:24](=[O:25])([O-:26])[O-:27].[CH3:30][C:31]1([CH3:32])[C:33]([CH3:34])([CH3:35])[O:36][B:37]([c:38]2[cH:39][c:40]3[c:41]([n:42][o:43][n:44]3)[cH:45][cH:46]2)[O:47]1.[Cs+:28].[Cs+:29].[O:48]=[CH:49][N:50]([CH3:51])[CH3:52].[OH2:53]>>[c:2]1(-[c:38]2[cH:39][c:40]3[c:41]([n:42][o:43][n:44]3)[cH:45][cH:46]2)[cH:3][c:4]([CH:14]([C:15](=[O:16])[O:17][CH2:18][CH3:19])[CH2:20][CH:21]([CH3:22])[CH3:23])[cH:5][c:6]([Cl:13])[c:7]1[O:8][CH2:9][CH:10]1[CH2:11][CH2:12]1

Participants

7

Reactant 6

HCID 962WaterHCID 6228DimethylformamideHCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 467380042,1,3-Benzoxadiazole-5-boronic acid, pinacol esterHCID 68732072Ethyl 2-(3-bromo-5-chloro-4-(cyclopropylmethoxy)phenyl)-4-methylpentanoate

Product 1

HCID 57995660Ethyl 2-(3-(benzo[c][1,2,5]oxadiazol-5-yl)-5-chloro-4-(cyclopropylmethoxy)phenyl)-4-methylpentanoate

Sources & evidence

ORD record
ord-471725d579934848bc70651891a62b81
Source dataset
Validation data from https://doi.org/10.1039/C8SC04228D

Reaction notes

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