Acetic Acid → HCID 58529523, compound

HRID 1120273Notes

Reaction equation

HRID 1120273 reaction equation
[C:34]([OH:35])(=[O:36])[CH3:37].[C:49]([BH3-:50])#[N:51].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[n:8]1[n:9][c:10]2[cH:11][c:12](-[c:17]3[cH:18][c:19]([CH2:27][CH:28]4[CH2:29][O:30][CH2:31][CH2:32][NH:33]4)[n:20]4[n:21][cH:22][n:23][c:24]([NH2:26])[c:25]34)[cH:13][cH:14][c:15]2[cH:16]1.[CH2:38]([O:39][C:41]1([O:40][Si:44]([CH3:45])([CH3:46])[CH3:47])[CH2:42][CH2:43]1)[CH3:48].[CH3:55][OH:56].[Na+:52].[Na+:54].[OH-:53]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[n:8]1[n:9][c:10]2[cH:11][c:12](-[c:17]3[cH:18][c:19]([CH2:27][CH:28]4[CH2:29][O:30][CH2:31][CH2:32][N:33]4[CH:41]4[CH2:42][CH2:43]4)[n:20]4[n:21][cH:22][n:23][c:24]([NH2:26])[c:25]34)[cH:13][cH:14][c:15]2[cH:16]1

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 887MethanolHCID 923Sodium ion2×HCID 961HydroxideHCID 498716Cyano-borohydrideHCID 2734686(1-Ethoxycyclopropoxy)trimethylsilaneHCID 58529968HCID 58529968, compound

Product 1

HCID 58529523HCID 58529523, compound

Sources & evidence

ORD record
ord-fd4615fdcb0f41708e44a5cf47ee84a9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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