Acetic Acid → HCID 86658579, compound

HRID 104467Notes

Reaction equation

HRID 104467 reaction equation
[C:39]([OH:40])(=[O:41])[CH3:42].[CH:1]1([NH:4][C:5](=[O:6])[NH:7][c:8]2[cH:9][c:10]([F:37])[c:11]([O:14][c:15]3[c:16]4[c:17]([n:18][cH:19][cH:20]3)[cH:21][c:22](-[c:24]3[n:25][cH:26][n:27]([CH2:29][CH:30]([O:31][CH2:35][CH3:36])[O:32][CH2:33][CH3:34])[cH:28]3)[s:23]4)[cH:12][cH:13]2)[CH2:2][CH2:3]1.[ClH:38].[OH2:43]>>[CH:1]1([NH:4][C:5](=[O:6])[NH:7][c:8]2[cH:9][c:10]([F:37])[c:11]([O:14][c:15]3[c:16]4[c:17]([n:18][cH:19][cH:20]3)[cH:21][c:22](-[c:24]3[n:25][cH:26][n:27]([CH2:29][CH:30]=[O:31])[cH:28]3)[s:23]4)[cH:12][cH:13]2)[CH2:2][CH2:3]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 313Hydrochloric AcidHCID 962WaterHCID 67441318HCID 67441318, compound

Product 1

HCID 86658579HCID 86658579, compound

Sources & evidence

ORD record
ord-e755614e6aa24a17aed4ea30c926db5f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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