Water → HCID 58392391, compound

HRID 2139269Notes

Reaction equation

HRID 2139269 reaction equation
[Al+3:29].[CH3:35][C:36]#[N:37].[Cl:1][c:2]1[c:3]([F:27])[cH:4][c:5]([CH:8]([CH2:9][C:10](=[O:11])[O:12][CH2:13][CH3:14])[c:15]2[cH:16][nH:17][c:18]3[c:19]([CH2:24][S:25][CH3:26])[cH:20][cH:21][cH:22][c:23]23)[cH:6][cH:7]1.[H-:28].[H-:31].[H-:32].[H-:33].[Li+:30].[O:38]1[CH2:39][CH2:40][CH2:41][CH2:42]1.[OH2:34]>>[Cl:1][c:2]1[c:3]([F:27])[cH:4][c:5]([CH:8]([CH2:9][CH2:10][OH:11])[c:15]2[cH:16][nH:17][c:18]3[c:19]([CH2:24][S:25][CH3:26])[cH:20][cH:21][cH:22][c:23]23)[cH:6][cH:7]1

Participants

8

Reactant 7

HCID 962WaterHCID 6342AcetonitrileHCID 8028TetrahydrofuranHCID 28486Lithium ionHCID 104727Aluminum CationHCID 166653Hydride4×HCID 58392178HCID 58392178, compound

Product 1

HCID 58392391HCID 58392391, compound

Sources & evidence

ORD record
ord-5efbbff88dc6426a8a1d3cf456202319
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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