Hydrochloric Acid → HCID 68987739, compound

HRID 668528Notes

Reaction equation

HRID 668528 reaction equation
[CH2:1]([CH:2]([CH3:3])[CH3:4])[O:5][c:6]1[c:7]([C:8](=[O:9])[c:10]2[cH:11][cH:12][c:13]([O:19][CH2:20][CH:21]([CH3:22])[CH3:23])[c:14]([C:15](=[O:16])[OH:17])[cH:18]2)[cH:24][cH:25][c:26]([O:28][CH2:29][CH:30]([CH3:31])[CH3:32])[cH:27]1.[CH2:45]([CH3:46])[O:47][C:48]([CH2:49][NH2:50])=[O:51].[CH3:39][N:40]([CH3:41])[CH:42]=[O:43].[CH3:62][CH2:63][N:64]([CH2:65][CH3:66])[CH2:67][CH3:68].[CH:58]([Cl:59])([Cl:60])[Cl:61].[Cl:33][C:34]([C:35]([Cl:36])=[O:37])=[O:38].[ClH:44].[O:52]1[CH2:53][CH2:54][CH2:55][CH2:56]1.[OH2:57]>>[CH2:1]([CH:2]([CH3:3])[CH3:4])[O:5][c:6]1[c:7]([C:8](=[O:9])[c:10]2[cH:11][cH:12][c:13]([O:19][CH2:20][CH:21]([CH3:22])[CH3:23])[c:14]([C:15](=[O:16])[NH:50][CH2:49][C:48]([O:47][CH2:45][CH3:46])=[O:51])[cH:18]2)[cH:24][cH:25][c:26]([O:28][CH2:29][CH:30]([CH3:31])[CH3:32])[cH:27]1

Participants

10

Reactant 9

HCID 313Hydrochloric AcidHCID 962WaterHCID 6212ChloroformHCID 6228DimethylformamideHCID 8028TetrahydrofuranHCID 8471TriethylamineHCID 12176Glycine ethyl esterHCID 65578Oxalyl chlorideHCID 17816566HCID 17816566, compound

Product 1

HCID 68987739HCID 68987739, compound

Sources & evidence

ORD record
ord-947e0b2fb1bc46c79ce1177eec94651e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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