Acetonitrile → HCID 70420061, compound

HRID 1215193Notes

Reaction equation

HRID 1215193 reaction equation
[CH3:44][C:45]#[N:46].[Cl:1][CH2:2][CH:3]=[CH:4][CH2:5][O:6][c:7]1[c:8]([CH:16]2[C:17]([C:28](=[O:29])[O:30][CH3:31])=[C:18]([CH3:27])[NH:19][C:20]([CH3:26])=[C:21]2[C:22](=[O:23])[O:24][CH3:25])[cH:9][c:10]([N+:13](=[O:14])[O-:15])[cH:11][cH:12]1.[OH:32][CH:33]([CH2:34][NH2:35])[CH2:36][O:37][c:38]1[cH:39][cH:40][cH:41][cH:42][cH:43]1>>[CH2:2]([CH:3]=[CH:4][CH2:5][O:6][c:7]1[c:8]([CH:16]2[C:17]([C:28](=[O:29])[O:30][CH3:31])=[C:18]([CH3:27])[NH:19][C:20]([CH3:26])=[C:21]2[C:22](=[O:23])[O:24][CH3:25])[cH:9][c:10]([N+:13](=[O:14])[O-:15])[cH:11][cH:12]1)[NH:35][CH2:34][CH:33]([OH:32])[CH2:36][O:37][c:38]1[cH:39][cH:40][cH:41][cH:42][cH:43]1

Participants

4

Reactant 3

HCID 6342AcetonitrileHCID 27250731-Amino-3-phenoxypropan-2-olHCID 70419352HCID 70419352, compound

Product 1

HCID 70420061HCID 70420061, compound

Sources & evidence

ORD record
ord-85de0ddad47848d7859845ae67b5e303
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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