Ethanol → HCID 178421452, compound

HRID 140442Notes

Reaction equation

HRID 140442 reaction equation
[BH4-:44].[CH3:51][CH2:52][OH:53].[F:1][CH:2]1[CH:3]2[c:4]3[cH:5][cH:6][c:7]([OH:43])[cH:8][c:9]3[CH2:10][CH:11]([CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][N:26]3[CH:27]([CH2:31][S:32][CH2:33][CH2:34][CH2:35][C:36]([C:37]([F:38])([F:39])[F:40])([F:41])[F:42])[CH2:28][CH2:29][CH2:30]3)[CH:12]2[CH:13]2[CH2:14][CH2:15][C:16](=[O:20])[C:17]2([CH3:18])[CH2:19]1.[Na+:45].[O:46]1[CH2:47][CH2:48][CH2:49][CH2:50]1.[OH2:54]>>[F:1][CH:2]1[CH:3]2[c:4]3[cH:5][cH:6][c:7]([OH:43])[cH:8][c:9]3[CH2:10][CH:11]([CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][N:26]3[CH:27]([CH2:31][S:32][CH2:33][CH2:34][CH2:35][C:36]([C:37]([F:38])([F:39])[F:40])([F:41])[F:42])[CH2:28][CH2:29][CH2:30]3)[CH:12]2[CH:13]2[CH2:14][CH2:15][CH:16]([OH:20])[C:17]2([CH3:18])[CH2:19]1

Participants

7

Reactant 6

HCID 702EthanolHCID 923Sodium ionHCID 962WaterHCID 8028TetrahydrofuranHCID 28123BorohydrideHCID 178421451HCID 178421451, compound

Product 1

HCID 178421452HCID 178421452, compound

Sources & evidence

ORD record
ord-c01f27c7ebe3414f99e3ecc2d9867462
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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