Acetic Acid → HCID 178424298, compound

HRID 1209986Notes

Reaction equation

HRID 1209986 reaction equation
[CH3:21][O:22][C:23](=[O:24])[CH2:25][CH:26]([O:27][C:28](=[O:29])[c:30]1[c:31]([CH3:36])[cH:32][cH:33][cH:34][cH:35]1)[CH:37]([OH:38])[CH2:39][O:40][C:41](=[O:42])[c:43]1[c:44]([CH3:49])[cH:45][cH:46][cH:47][cH:48]1.[CH3:50][OH:51].[CH3:52][C:53](=[O:54])[OH:55].[CH3:56][CH2:57][O:58][CH2:59][CH3:60].[CH:62]([Cl:63])([Cl:64])[Cl:65].[ClH:10].[O:1]=[CH:2][CH2:3][CH:4]([CH:5]([CH2:6][OH:7])[OH:8])[OH:9].[OH2:61].[c:11]1([CH3:12])[cH:13][cH:14][c:15]([C:16](=[O:17])[Cl:19])[cH:18][cH:20]1.[cH:66]1[cH:67][cH:68][n:69][cH:70][cH:71]1>>[Cl:19][C:23](=[O:22])[CH2:25][CH:26]([O:27][C:28](=[O:29])[c:30]1[c:31]([CH3:36])[cH:32][cH:33][cH:34][cH:35]1)[CH:37]([OH:38])[CH2:39][O:40][C:41](=[O:42])[c:43]1[c:44]([CH3:49])[cH:45][cH:46][cH:47][cH:48]1

Participants

11

Reactant 10

HCID 176Acetic AcidHCID 313Hydrochloric AcidHCID 887MethanolHCID 962WaterHCID 1049PyridineHCID 3283Diethyl EtherHCID 6212ChloroformHCID 107862-DeoxypentoseHCID 134054-Methylbenzoyl ChlorideHCID 178500935HCID 178500935, compound

Product 1

HCID 178424298HCID 178424298, compound

Sources & evidence

ORD record
ord-391df7263ef64ef7a963abe66719c15d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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