Acetic Acid → HCID 66772969, compound

HRID 2317167Notes

Reaction equation

HRID 2317167 reaction equation
[C:36]([O:37][BH-:38]([O:39][C:40](=[O:41])[CH3:42])[O:43][C:44](=[O:45])[CH3:46])(=[O:47])[CH3:48].[CH3:53][C:54](=[O:55])[OH:56].[Cl:50][CH2:51][Cl:52].[ClH:1].[ClH:2].[F:14][c:15]1[cH:16][cH:17][c:18](-[n:21]2[n:22][c:23]([CH:34]=[O:35])[c:24]3[c:25]([C:30](=[O:31])[O:32][CH3:33])[cH:26][cH:27][cH:28][c:29]23)[cH:19][cH:20]1.[H-:12].[NH2:3][CH:4]1[CH2:5][N:6]2[CH2:7][CH2:8][CH:9]1[CH2:10][CH2:11]2.[Na+:13].[Na+:49]>>[NH:3]([CH:4]1[CH2:5][N:6]2[CH2:7][CH2:8][CH:9]1[CH2:10][CH2:11]2)[CH2:34][c:23]1[n:22][n:21](-[c:18]2[cH:17][cH:16][c:15]([F:14])[cH:20][cH:19]2)[c:29]2[c:24]1[c:25]([C:30](=[O:31])[O:32][CH3:33])[cH:26][cH:27][cH:28]2

Participants

9

Reactant 8

HCID 176Acetic AcidHCID 313Hydrochloric Acid2×HCID 923Sodium ion2×HCID 6344DichloromethaneHCID 1232383-AminoquinuclidineHCID 166653HydrideHCID 2724942TriacetoxyborohydrideHCID 86636562HCID 86636562, compound

Product 1

HCID 66772969HCID 66772969, compound

Sources & evidence

ORD record
ord-f885a1ba9c774c929a5a001c42f99a32
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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