Ethanol → HCID 178458195, compound

HRID 683165Notes

Reaction equation

HRID 683165 reaction equation
[CH3:57][CH2:58][OH:59].[CH3:60][c:61]1[cH:62][cH:63][cH:64][cH:65][cH:66]1.[CH:28]([CH3:29])([CH3:30])[O:31][c:32]1[cH:33][c:34]([B:45]([OH:46])[OH:47])[cH:35][cH:36][c:37]1[C:38](=[O:39])[NH:40][S:41](=[O:42])(=[O:43])[CH3:44].[Cl:48][CH2:49][Cl:50].[Na+:51].[Na+:52].[O-:53][C:54](=[O:55])[O-:56].[OH:1][CH:2]([CH2:3][N:4]([C:5]([O:6][C:7]([CH3:8])([CH3:9])[CH3:10])=[O:11])[CH2:12][CH2:13][O:14][c:15]1[cH:16][cH:17][c:18]([I:21])[cH:19][cH:20]1)[c:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1>>[OH:1][CH:2]([CH2:3][N:4]([C:5]([O:6][C:7]([CH3:8])([CH3:9])[CH3:10])=[O:11])[CH2:12][CH2:13][O:14][c:15]1[cH:16][cH:17][c:18](-[c:34]2[cH:33][c:32]([O:31][CH:28]([CH3:29])[CH3:30])[c:37]([C:38](=[O:39])[NH:40][S:41](=[O:42])(=[O:43])[CH3:44])[cH:36][cH:35]2)[cH:19][cH:20]1)[c:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1

Participants

8

Reactant 7

HCID 702EthanolHCID 923Sodium ion2×HCID 1140TolueneHCID 6344DichloromethaneHCID 19660Carbonate IonHCID 69103532HCID 69103532, compoundHCID 178453732HCID 178453732, compound

Product 1

HCID 178458195HCID 178458195, compound

Sources & evidence

ORD record
ord-a0030c92ff1246129fe7582f483da193
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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