Glycerol → 2,3-Dihydroxypropyl 4-(n-hexadecylamino)benzoate

HRID 663604Notes

Reaction equation

HRID 663604 reaction equation
[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH3:16])[NH:17][c:18]1[cH:19][cH:20][c:21]([C:22](=[O:23])[OH:24])[cH:25][cH:26]1.[Na+:38].[Na+:39].[O-:40][C:41](=[O:42])[O-:43].[OH:44][CH2:45][CH:46]([OH:47])[CH2:48][OH:49].[c:27]1([CH3:28])[cH:29][cH:30][c:31]([S:32]([OH:33])(=[O:34])=[O:35])[cH:36][cH:37]1>>[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH3:16])[NH:17][c:18]1[cH:19][cH:20][c:21]([C:22](=[O:23])[O:24][CH2:48][CH:46]([CH2:45][OH:44])[OH:47])[cH:25][cH:26]1

Participants

6

Reactant 5

HCID 753GlycerolHCID 923Sodium ion2×HCID 6101p-Toluenesulfonic acidHCID 19660Carbonate IonHCID 472634-(Hexadecylamino)benzoic acid

Product 1

HCID 130193802,3-Dihydroxypropyl 4-(n-hexadecylamino)benzoate

Sources & evidence

ORD record
ord-b5c270ebb408483fbf6ff41ea15e03b7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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