Ethylene Glycol → HCID 15512221, compound

HRID 2146765Notes

Reaction equation

HRID 2146765 reaction equation
[Br:22][c:23]1[c:24]([NH2:25])[cH:26][cH:27][c:28]([CH:30]([CH3:31])[CH3:32])[cH:29]1.[CH:33]([N:34]([CH:35]([CH3:36])[CH3:37])[CH2:38][CH3:39])([CH3:40])[CH3:41].[ClH:21].[Na+:42].[OH:43][C:44](=[O:45])[O-:46].[OH:47][CH2:48][CH2:49][OH:50].[c:1]1([C:7]2=[CH:12][CH2:11][N:10]([c:13]3[n:14][c:15]([Cl:20])[n:16][c:17]([CH3:19])[cH:18]3)[CH2:9][CH2:8]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([C:7]2=[CH:12][CH2:11][N:10]([c:13]3[n:14][c:15]([NH:25][c:24]4[c:23]([Br:22])[cH:29][c:28]([CH:30]([CH3:31])[CH3:32])[cH:27][cH:26]4)[n:16][c:17]([CH3:19])[cH:18]3)[CH2:9][CH2:8]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

8

Reactant 7

HCID 174Ethylene GlycolHCID 313Hydrochloric AcidHCID 769Bicarbonate IonHCID 923Sodium ionHCID 81531DiisopropylethylamineHCID 5213372-Bromo-4-isopropylanilineHCID 15512220HCID 15512220, compound

Product 1

HCID 15512221HCID 15512221, compound

Sources & evidence

ORD record
ord-090140f65a224998b288bc897d945245
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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