Acetic Acid → HCID 178459343, compound

HRID 1561270Notes

Reaction equation

HRID 1561270 reaction equation
[CH2:50]1[O:51][CH2:52][CH2:53][CH2:54]1.[CH3:41][C:42](=[O:43])[OH:44].[Na+:45].[O:1]=[C:2]1[CH:3]([CH:30]([CH3:31])[O:32][Si:33]([CH2:34][CH3:35])([CH2:36][CH3:37])[CH2:38][CH3:39])[CH:4]2[CH2:5][C:6]([c:15]3[cH:16][c:17]([CH2:21][O:22][Si:23]([CH2:24][CH3:25])([CH2:26][CH3:27])[CH2:28][CH3:29])[cH:18][cH:19][cH:20]3)=[C:7]([C:9](=[O:10])[O:11][CH2:12][CH:13]=[CH2:14])[N:8]12.[OH2:40].[OH:46][C:47](=[O:48])[O-:49]>>[O:1]=[C:2]1[CH:3]([CH:30]([CH3:31])[O:32][Si:33]([CH2:34][CH3:35])([CH2:36][CH3:37])[CH2:38][CH3:39])[CH:4]2[CH2:5][C:6]([c:15]3[cH:16][c:17]([CH2:21][OH:22])[cH:18][cH:19][cH:20]3)=[C:7]([C:9](=[O:10])[O:11][CH2:12][CH:13]=[CH2:14])[N:8]12

Participants

7

Reactant 6

HCID 176Acetic AcidHCID 769Bicarbonate IonHCID 923Sodium ionHCID 962WaterHCID 8028TetrahydrofuranHCID 178459348HCID 178459348, compound

Product 1

HCID 178459343HCID 178459343, compound

Sources & evidence

ORD record
ord-fbd7a14d9033499abe229c7c77a79bc4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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