Ethylene Glycol → HCID 15432352, compound

HRID 682110Notes

Reaction equation

HRID 682110 reaction equation
[C:33](=[O:34])([OH:35])[O-:36].[CH3:26][CH2:27][N:28]([CH2:29][CH3:30])[CH2:31][CH3:32].[Cl:1][CH2:2][c:3]1[n:4][c:5]2[n:6]([cH:7][c:8]([CH3:11])[cH:9][cH:10]2)[cH:12]1.[F:13][c:14]1[cH:15][cH:16][c:17]([N:20]2[CH2:21][CH2:22][NH:23][CH2:24][CH2:25]2)[cH:18][cH:19]1.[Na+:37].[OH:38][CH2:39][CH2:40][OH:41]>>[CH2:2]([c:3]1[n:4][c:5]2[n:6]([cH:7][c:8]([CH3:11])[cH:9][cH:10]2)[cH:12]1)[N:23]1[CH2:22][CH2:21][N:20]([c:17]2[cH:16][cH:15][c:14]([F:13])[cH:19][cH:18]2)[CH2:25][CH2:24]1

Participants

7

Reactant 6

HCID 174Ethylene GlycolHCID 769Bicarbonate IonHCID 923Sodium ionHCID 8471TriethylamineHCID 752601-(4-Fluorophenyl)piperazineHCID 3345586HCID 3345586, compound

Product 1

HCID 15432352HCID 15432352, compound

Sources & evidence

ORD record
ord-be4c1ba2be1148d3908f555e95ea958e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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