Hydrochloric Acid → 2-(3-(Hydroxymethyl)-6-nitro-2,3-dihydrobenzo[b][1,4]dioxin-5-yl)acetonitrile
Reaction equation
[CH3:27][C:28]([CH3:29])([O-:30])[CH3:31].[Cl:16][c:17]1[cH:18][cH:19][c:20]([O:21][CH2:22][C:23]#[N:24])[cH:25][cH:26]1.[ClH:33].[K+:32].[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]2[c:8]([cH:15]1)[O:9][CH:10]([CH2:13][OH:14])[CH2:11][O:12]2.[O:34]=[CH:35][N:36]([CH3:37])[CH3:38].[OH2:39]>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]2[c:8]([c:15]1[CH2:22][C:23]#[N:24])[O:9][CH:10]([CH2:13][OH:14])[CH2:11][O:12]2Participants
8
Sources & evidence
- ORD record
- ord-dea2b2d209f944579919a964e0eda1af
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
Loading…
