Ethanol → HCID 178504277, compound

HRID 302229Notes

Reaction equation

HRID 302229 reaction equation
[C:1](#[N:2])[c:3]1[cH:4][cH:5][c:6]([CH2:7][N:8]([C:9](=[O:10])[O:11][CH2:12][CH2:13][Si:14]([CH3:15])([CH3:16])[CH3:17])[CH2:18][CH:19]([CH:20]([CH2:21][CH:22]2[CH2:23][CH2:24][CH2:25][CH2:26][CH2:27]2)[NH:28][C:29](=[O:30])[O:31][C:32]([CH3:33])([CH3:34])[CH3:35])[OH:36])[cH:37][cH:38]1.[CH3:51][CH2:52][OH:53].[OH2:39].[c:40]1([CH3:41])[c:42]([S:43]([OH:44])(=[O:45])=[O:46])[cH:47][cH:48][cH:49][cH:50]1>>[C:1](#[N:2])[c:3]1[cH:4][cH:5][c:6]([CH2:7][N:8]([C:9](=[O:10])[O:11][CH2:12][CH2:13][Si:14]([CH3:15])([CH3:16])[CH3:17])[CH2:18][CH:19]([CH:20]([CH2:21][CH:22]2[CH2:23][CH2:24][CH2:25][CH2:26][CH2:27]2)[NH2:28])[OH:36])[cH:37][cH:38]1

Participants

5

Reactant 4

HCID 702EthanolHCID 962WaterHCID 69252-Methylbenzenesulfonic acidHCID 178453227HCID 178453227, compound

Product 1

HCID 178504277HCID 178504277, compound

Sources & evidence

ORD record
ord-5e7fd6fb00b447c689e9d462e17f680a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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