Triethyl phosphonoacetate → HCID 91512442, compound
Reaction equation
[CH2:1]([CH2:2][CH2:3][CH3:4])[c:5]1[c:6](-[c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[c:7]([O:17][c:18]2[cH:19][cH:20][c:21]([CH:22]=[O:23])[cH:24][cH:25]2)[c:8]2[cH:9][cH:10][c:11]([O:15][CH3:16])[cH:12][c:13]2[cH:14]1.[CH3:32][CH2:33][O:34][C:35](=[O:36])[CH2:37][P:38]([O:39][CH2:40][CH3:41])([O:42][CH2:43][CH3:44])=[O:45].[CH3:46][CH2:47][CH2:48][CH2:49][Li:50]>>[CH2:1]([CH2:2][CH2:3][CH3:4])[c:5]1[c:6](-[c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[c:7]([O:17][c:18]2[cH:19][cH:20][c:21]([CH:22]=[CH:37][C:35]([O:34][CH2:33][CH3:32])=[O:36])[cH:24][cH:25]2)[c:8]2[cH:9][cH:10][c:11]([O:15][CH3:16])[cH:12][c:13]2[cH:14]1Participants
4
Sources & evidence
- ORD record
- ord-024ff0954ca44ac7b2bb331bc72917ac
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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