Sodium ion → 1-(1-Octyloxy)ethyl acetate

HRID 90571

Reaction equation

HRID 90571 reaction equation
[C:33]([O:34][CH2:35][CH2:36][CH2:37][CH2:38][CH2:39][CH2:40][CH2:41][CH3:42])(=[O:43])[CH3:44].[CH2:7]([CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH3:14])[OH:15].[CH3:16][C:17](=[O:18])[O:19][CH:20]=[CH2:21].[CH3:45][c:46]1[cH:47][cH:48][cH:49][cH:50][cH:51]1.[CH:22]([O:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH3:31])=[CH2:32].[Na+:1].[Na+:2].[O-:3][C:4](=[O:5])[O-:6]>>[CH2:7]([CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH3:14])[O:15][CH:20]([O:19][C:17]([CH3:16])=[O:18])[CH3:21]

Participants

8

Reactant 7

HCID 923Sodium ion2×HCID 9571-OctanolHCID 1140TolueneHCID 7904Vinyl AcetateHCID 8164Octyl AcetateHCID 19660Carbonate IonHCID 702491-(Vinyloxy)octane

Product 1

HCID 220345371-(1-Octyloxy)ethyl acetate

Sources & evidence

ORD record
ord-4097b3eaa40d450497c5a60ed49013cc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

Loading…