Water → HCID 57794793, compound

HRID 2323939Notes

Reaction equation

HRID 2323939 reaction equation
[CH2:29]([Al+:30][CH2:31][CH:32]([CH3:33])[CH3:34])[CH:35]([CH3:36])[CH3:37].[CH3:1][c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1.[H-:28].[O:39]1[CH2:40][CH2:41][CH2:42][CH2:43]1.[OH2:38].[c:8]1([C:14]2([C:26]#[N:27])[CH:15]([CH2:17][O:18][CH2:19][c:20]3[cH:21][cH:22][cH:23][cH:24][cH:25]3)[CH2:16]2)[cH:9][cH:10][cH:11][cH:12][cH:13]1>>[c:8]1([C:14]2([CH:26]=[O:38])[CH:15]([CH2:17][O:18][CH2:19][c:20]3[cH:21][cH:22][cH:23][cH:24][cH:25]3)[CH2:16]2)[cH:9][cH:10][cH:11][cH:12][cH:13]1

Participants

7

Reactant 6

HCID 962WaterHCID 1140TolueneHCID 8028TetrahydrofuranHCID 166653HydrideHCID 16686348Bis(2-methylpropyl)alumanyliumHCID 57794822HCID 57794822, compound

Product 1

HCID 57794793HCID 57794793, compound

Sources & evidence

ORD record
ord-780c1e1cb0794b54831c8a98269a93c9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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