Sodium ion → pentyl[2'-(1-trityl-1H-tetrazol-5-yl)biphenyl-4-ylmethyl]amine

HRID 1208829Notes

Reaction equation

HRID 1208829 reaction equation
[Al+3:46].[C:1]([CH2:2][CH2:3][CH2:4][CH3:5])(=[O:6])[NH:7][CH2:8][c:9]1[cH:10][cH:11][c:12](-[c:15]2[c:16](-[c:21]3[n:22][n:23][n:24][n:25]3[C:26]([c:27]3[cH:28][cH:29][cH:30][cH:31][cH:32]3)([c:33]3[cH:34][cH:35][cH:36][cH:37][cH:38]3)[c:39]3[cH:40][cH:41][cH:42][cH:43][cH:44]3)[cH:17][cH:18][cH:19][cH:20]2)[cH:13][cH:14]1.[H-:45].[H-:48].[H-:49].[H-:50].[Li+:47].[Na+:53].[O:54]1[CH2:55][CH2:56][CH2:57][CH2:58]1.[OH-:52].[OH2:51]>>[CH2:1]([CH2:2][CH2:3][CH2:4][CH3:5])[NH:7][CH2:8][c:9]1[cH:10][cH:11][c:12](-[c:15]2[c:16](-[c:21]3[n:22][n:23][n:24][n:25]3[C:26]([c:27]3[cH:28][cH:29][cH:30][cH:31][cH:32]3)([c:33]3[cH:34][cH:35][cH:36][cH:37][cH:38]3)[c:39]3[cH:40][cH:41][cH:42][cH:43][cH:44]3)[cH:17][cH:18][cH:19][cH:20]2)[cH:13][cH:14]1

Participants

9

Reactant 8

HCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 8028TetrahydrofuranHCID 28486Lithium ionHCID 104727Aluminum CationHCID 166653Hydride4×HCID 23569449HCID 23569449, compound

Product 1

HCID 19024425pentyl[2'-(1-trityl-1H-tetrazol-5-yl)biphenyl-4-ylmethyl]amine

Sources & evidence

ORD record
ord-7577ca780df741cbb068c5dadffd46f5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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