Ethylene Glycol → HCID 57585939, compound

HRID 696166Notes

Reaction equation

HRID 696166 reaction equation
[CH3:36][c:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1.[CH3:43][CH2:44][O:45][C:46](=[O:47])[CH3:48].[NH2:1][c:2]1[c:3]([N+:18](=[O:19])[O-:20])[cH:4][c:5]([O:8][c:9]2[c:10]([Cl:17])[cH:11][c:12]([CH:13]=[O:14])[cH:15][cH:16]2)[cH:6][cH:7]1.[OH:21][CH2:22][CH2:23][OH:24].[c:25]1([CH3:26])[cH:27][cH:28][c:29]([S:30]([OH:31])(=[O:32])=[O:33])[cH:34][cH:35]1>>[NH2:1][c:2]1[c:3]([N+:18](=[O:19])[O-:20])[cH:4][c:5]([O:8][c:9]2[c:10]([Cl:17])[cH:11][c:12]([CH:13]3[O:14][CH2:23][CH2:22][O:21]3)[cH:15][cH:16]2)[cH:6][cH:7]1

Participants

6

Reactant 5

HCID 174Ethylene GlycolHCID 1140TolueneHCID 6101p-Toluenesulfonic acidHCID 8857Ethyl AcetateHCID 57585846HCID 57585846, compound

Product 1

HCID 57585939HCID 57585939, compound

Sources & evidence

ORD record
ord-e27144bcc25e4144bf4d525b41e06583
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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