Acetic Acid → HCID 54358010, compound

HRID 173446Notes

Reaction equation

HRID 173446 reaction equation
[C:34](=[O:35])([O-:36])[O-:37].[C:8](=[O:9])([OH:10])[CH:11]=[CH:12][c:13]1[n:14](-[c:18]2[cH:19][c:20]([C:21](=[O:22])[N:23]=[C:24]([NH2:25])[NH2:26])[cH:27][cH:28][cH:29]2)[cH:15][cH:16][cH:17]1.[CH3:1][Si:2]([CH:3]=[N+:4]=[N-:5])([CH3:6])[CH3:7].[CH3:30][C:31](=[O:32])[OH:33].[CH3:40][CH2:41][CH2:42][CH2:43][CH2:44][CH3:45].[CH3:51][OH:52].[CH3:54][CH2:55][O:56][C:57](=[O:58])[CH3:59].[K+:38].[K+:39].[O:46]1[CH2:47][CH2:48][CH2:49][CH2:50]1.[OH2:53]>>[CH3:1][O:9][C:8](=[O:10])[CH:11]=[CH:12][c:13]1[n:14](-[c:18]2[cH:19][c:20]([C:21](=[O:22])[N:23]=[C:24]([NH2:25])[NH2:26])[cH:27][cH:28][cH:29]2)[cH:15][cH:16][cH:17]1

Participants

11

Reactant 10

HCID 176Acetic AcidHCID 813Potassium Cation2×HCID 887MethanolHCID 962WaterHCID 8028TetrahydrofuranHCID 8058HexaneHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 167693TrimethylsilyldiazomethaneHCID 70199520HCID 70199520, compound

Product 1

HCID 54358010HCID 54358010, compound

Sources & evidence

ORD record
ord-ffe668ef6d0d4465aa601340cda18bbb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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