Acetic Acid → HCID 178525202, compound

HRID 2154822Notes

Reaction equation

HRID 2154822 reaction equation
[C:1](=[O:2])([CH3:3])[S:4][CH:5]1[CH2:6][CH:7]([CH2:23][O:24][CH2:25][CH2:26][F:27])[N:8]([C:10](=[O:11])[O:12][CH2:13][c:14]2[cH:15][cH:16][c:17]([N+:20](=[O:21])[O-:22])[cH:18][cH:19]2)[CH2:9]1.[CH3:28][O-:29].[CH3:31][C:32](=[O:33])[OH:34].[CH3:36][OH:37].[CH3:38][CH2:39][O:40][C:41](=[O:42])[CH3:43].[Na+:30].[OH2:35]>>[SH:4][CH:5]1[CH2:6][CH:7]([CH2:23][O:24][CH2:25][CH2:26][F:27])[N:8]([C:10](=[O:11])[O:12][CH2:13][c:14]2[cH:15][cH:16][c:17]([N+:20](=[O:21])[O-:22])[cH:18][cH:19]2)[CH2:9]1

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 887MethanolHCID 923Sodium ionHCID 962WaterHCID 8857Ethyl AcetateHCID 3826051MethoxideHCID 178477019HCID 178477019, compound

Product 1

HCID 178525202HCID 178525202, compound

Sources & evidence

ORD record
ord-0532589b763b41e8a1d58842cfe464fa
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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