Hydrochloric Acid → Hydrochloric Acid

HRID 125484Notes

Reaction equation

HRID 125484 reaction equation
[CH3:51][CH2:52][O:53][C:54](=[O:55])[CH3:56].[CH:41]([O:42][CH:43]([CH3:44])[CH3:45])([CH3:46])[CH3:47].[Cl:48][CH2:49][Cl:50].[ClH:40].[NH2:1][c:2]1[n:3][cH:4][cH:5][cH:6][c:7]1-[c:8]1[n:9][c:10]2[c:11]([n:12][c:13](-[c:16]3[cH:17][cH:18][cH:19][cH:20][cH:21]3)[cH:14][cH:15]2)[n:22]1-[c:23]1[cH:24][cH:25][c:26]([C:29]([CH3:30])([CH3:31])[NH:32][C:33](=[O:34])[O:35][C:36]([CH3:37])([CH3:38])[CH3:39])[cH:27][cH:28]1>>[ClH:40].[NH2:1][c:2]1[n:3][cH:4][cH:5][cH:6][c:7]1-[c:8]1[n:9][c:10]2[c:11]([n:12][c:13](-[c:16]3[cH:17][cH:18][cH:19][cH:20][cH:21]3)[cH:14][cH:15]2)[n:22]1-[c:23]1[cH:24][cH:25][c:26]([C:29]([CH3:30])([CH3:31])[NH2:32])[cH:27][cH:28]1

Participants

7

Reactant 5

HCID 313Hydrochloric AcidHCID 6344DichloromethaneHCID 7914Diisopropyl EtherHCID 8857Ethyl AcetateHCID 86761992HCID 86761992, compound

Product 2

HCID 313Hydrochloric AcidHCID 53262404HCID 53262404, compound

Sources & evidence

ORD record
ord-ccc4704a329b4529ad92ef2fc61bfb2a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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