Hydrochloric Acid → HCID 21840360, compound

HRID 172909Notes

Reaction equation

HRID 172909 reaction equation
[C:41]([CH2:42][CH2:43][CH2:44][CH3:45])(=[O:46])[Cl:47].[CH2:2]([c:3]1[cH:4][cH:5][cH:6][cH:7][cH:8]1)[O:9][C:10]([CH:11]([NH:12][CH2:13][c:14]1[cH:15][cH:16][c:17](-[c:20]2[c:21]([C:26]#[N:27])[cH:22][cH:23][cH:24][cH:25]2)[cH:18][cH:19]1)[CH:28]([CH3:29])[CH3:30])=[O:31].[CH:32]([N:33]([CH:34]([CH3:35])[CH3:36])[CH2:37][CH3:38])([CH3:39])[CH3:40].[ClH:1]>>[CH2:2]([c:3]1[cH:4][cH:5][cH:6][cH:7][cH:8]1)[O:9][C:10]([CH:11]([N:12]([CH2:13][c:14]1[cH:15][cH:16][c:17](-[c:20]2[c:21]([C:26]#[N:27])[cH:22][cH:23][cH:24][cH:25]2)[cH:18][cH:19]1)[C:41]([CH2:42][CH2:43][CH2:44][CH3:45])=[O:46])[CH:28]([CH3:29])[CH3:30])=[O:31]

Participants

5

Reactant 4

HCID 313Hydrochloric AcidHCID 61186Valeryl chlorideHCID 81531DiisopropylethylamineHCID 21840344HCID 21840344, compound

Product 1

HCID 21840360HCID 21840360, compound

Sources & evidence

ORD record
ord-633778d93a344d068e181b53738de949
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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