Hydrochloric Acid → HCID 57429630, compound

HRID 170830Notes

Reaction equation

HRID 170830 reaction equation
[CH3:42][CH2:43][OH:44].[CH3:46][CH2:47][O:48][C:49](=[O:50])[CH3:51].[ClH:45].[OH:1][CH2:2][c:3]1[cH:4][c:5]([C:9]#[C:10][CH2:11][n:12]2[n:13][cH:14][c:15](-[c:17]3[n:18][c:19]4[n:20]([CH2:39][CH2:40][CH3:41])[c:21](=[O:38])[n:22]([CH2:35][CH2:36][CH3:37])[c:23](=[O:34])[c:24]4[n:25]3[CH2:26][O:27][CH2:28][CH2:29][Si:30]([CH3:31])([CH3:32])[CH3:33])[cH:16]2)[cH:6][cH:7][cH:8]1>>[OH:1][CH2:2][c:3]1[cH:4][c:5]([C:9]#[C:10][CH2:11][n:12]2[n:13][cH:14][c:15](-[c:17]3[n:18][c:19]4[n:20]([CH2:39][CH2:40][CH3:41])[c:21](=[O:38])[n:22]([CH2:35][CH2:36][CH3:37])[c:23](=[O:34])[c:24]4[nH:25]3)[cH:16]2)[cH:6][cH:7][cH:8]1

Participants

5

Reactant 4

HCID 313Hydrochloric AcidHCID 702EthanolHCID 8857Ethyl AcetateHCID 57988795HCID 57988795, compound

Product 1

HCID 57429630HCID 57429630, compound

Sources & evidence

ORD record
ord-8bce7e11472140ebbe0a8204f501c7a8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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