Bicarbonate Ion → HCID 59835828, compound

HRID 204610Notes

Reaction equation

HRID 204610 reaction equation
[CH3:3][CH2:4][N:5]([CH2:6][CH3:7])[CH2:8][CH3:9].[CH3:41][C:42]#[N:43].[CH3:50][OH:51].[Cl:10][c:11]1[cH:12][cH:13][c:14](-[c:17]2[cH:18][cH:19][c:20]([C:23]#[C:24][c:25]3[cH:26][cH:27][c:28]([O:33][CH2:34][CH2:35][N:36]4[CH2:37][CH2:38][CH2:39][CH2:40]4)[c:29]([CH:30]=[O:31])[cH:32]3)[n:21][cH:22]2)[cH:15][cH:16]1.[NH2:1][OH:2].[Na+:49].[O-:45][C:46]([OH:47])=[O:48].[OH2:44]>>[N:1]([OH:2])=[CH:30][c:29]1[c:28]([O:33][CH2:34][CH2:35][N:36]2[CH2:37][CH2:38][CH2:39][CH2:40]2)[cH:27][cH:26][c:25]([C:24]#[C:23][c:20]2[cH:19][cH:18][c:17](-[c:14]3[cH:13][cH:12][c:11]([Cl:10])[cH:16][cH:15]3)[cH:22][n:21]2)[cH:32]1

Participants

9

Reactant 8

HCID 769Bicarbonate IonHCID 787HydroxylamineHCID 887MethanolHCID 923Sodium ionHCID 962WaterHCID 6342AcetonitrileHCID 8471TriethylamineHCID 59835895HCID 59835895, compound

Product 1

HCID 59835828HCID 59835828, compound

Sources & evidence

ORD record
ord-c5f6fa68afd3448b86569fd480bec9d1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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