Acetic Acid → HCID 66590858, compound

HRID 1200611Notes

Reaction equation

HRID 1200611 reaction equation
[CH3:32][OH:33].[CH3:3][N:4]([C:5]([CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH3:12])=[O:13])[CH2:14][c:15]1[cH:16][c:17](-[c:21]2[cH:22][cH:23][c:24]([CH:26]=[CH:27][C:28](=[O:29])[O:30][CH3:31])[s:25]2)[cH:18][cH:19][cH:20]1.[CH3:40][CH2:41][CH2:42][CH2:43][CH3:44].[CH3:45][C:46](=[O:47])[OH:48].[Na+:2].[O:34]1[CH2:35][CH2:36][CH2:37][CH2:38]1.[OH-:1].[OH2:39]>>[CH3:3][N:4]([C:5]([CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH3:12])=[O:13])[CH2:14][c:15]1[cH:16][c:17](-[c:21]2[cH:22][cH:23][c:24]([CH:26]=[CH:27][C:28](=[O:29])[OH:30])[s:25]2)[cH:18][cH:19][cH:20]1

Participants

9

Reactant 8

HCID 176Acetic AcidHCID 887MethanolHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 8003PentaneHCID 8028TetrahydrofuranHCID 66591402HCID 66591402, compound

Product 1

HCID 66590858HCID 66590858, compound

Sources & evidence

ORD record
ord-349e505a4a76402e962521b5b26ac5ef
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

Loading…