Triethyl phosphonoacetate → HCID 91395076, compound

HRID 694074Notes

Reaction equation

HRID 694074 reaction equation
[CH3:31][CH2:32][O:33][C:34](=[O:35])[CH2:36][P:37]([O:38][CH2:39][CH3:40])([O:41][CH2:42][CH3:43])=[O:44].[CH3:45][CH2:46][CH2:47][CH2:48][Li:49].[CH:1]1([c:4]2[c:5](-[c:25]3[cH:26][cH:27][cH:28][cH:29][cH:30]3)[c:6]([O:16][c:17]3[cH:18][cH:19][c:20]([CH:21]=[O:22])[cH:23][cH:24]3)[c:7]3[cH:8][cH:9][c:10]([O:14][CH3:15])[cH:11][c:12]3[cH:13]2)[CH2:2][CH2:3]1>>[CH:1]1([c:4]2[c:5](-[c:25]3[cH:26][cH:27][cH:28][cH:29][cH:30]3)[c:6]([O:16][c:17]3[cH:18][cH:19][c:20]([CH:21]=[CH:36][C:34]([O:33][CH2:32][CH3:31])=[O:35])[cH:23][cH:24]3)[c:7]3[cH:8][cH:9][c:10]([O:14][CH3:15])[cH:11][c:12]3[cH:13]2)[CH2:2][CH2:3]1

Participants

4

Reactant 3

HCID 13345Triethyl phosphonoacetateHCID 86616661HCID 86616661, compoundHCID 178418339Butyllithium

Product 1

HCID 91395076HCID 91395076, compound

Sources & evidence

ORD record
ord-7496731497e24f4fbe8d45c51d5bf737
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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