Aspirin → 3-(Benzyloxycarbonylamino)propyl 2-acetoxybenzoate

HRID 191180

Reaction equation

HRID 191180 reaction equation
[C:1]([CH3:2])(=[O:3])[O:4][c:5]1[c:6]([C:7](=[O:8])[OH:9])[cH:10][cH:11][cH:12][cH:13]1.[CH3:14][CH2:15][N:16]([CH2:17][CH3:18])[CH2:19][CH3:20].[Cl:36][CH2:37][Cl:38].[OH:21][CH2:22][CH2:23][CH2:24][NH:25][C:26]([O:27][CH2:28][c:29]1[cH:30][cH:31][cH:32][cH:33][cH:34]1)=[O:35]>>[C:1]([CH3:2])(=[O:3])[O:4][c:5]1[c:6]([C:7](=[O:8])[O:9][CH2:22][CH2:23][CH2:24][NH:25][C:26]([O:27][CH2:28][c:29]2[cH:30][cH:31][cH:32][cH:33][cH:34]2)=[O:35])[cH:10][cH:11][cH:12][cH:13]1

Participants

5

Reactant 4

HCID 2244AspirinHCID 6344DichloromethaneHCID 8471TriethylamineHCID 562256Benzyl N-(3-hydroxypropyl)carbamate

Product 1

HCID 591932393-(Benzyloxycarbonylamino)propyl 2-acetoxybenzoate

Sources & evidence

ORD record
ord-c8ff7155079645b3b615535a5c627f0b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Linked notes

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