Ethanol → HCID 178453816, compound

HRID 2127984Notes

Reaction equation

HRID 2127984 reaction equation
[CH2:1]([CH:2]([CH3:3])[CH3:4])[O:5][C:6](=[O:7])[NH:8][CH2:9][C:10](=[O:11])[OH:12].[CH2:39]1[O:40][CH2:41][CH2:42][CH2:43]1.[CH3:44][CH2:45][OH:46].[Cl:13][C:14]([O:15][CH2:16][CH:17]([CH3:18])[CH3:19])=[O:20].[NH2:21][c:22]1[n:23][nH:24][c:25]2[n:26][cH:27][n:28][c:29]([NH:31][c:32]3[cH:33][c:34]([Cl:38])[cH:35][cH:36][cH:37]3)[c:30]12>>[CH2:1]([CH:2]([CH3:3])[CH3:4])[O:5][C:6](=[O:7])[NH:8][CH2:9][C:10](=[O:12])[NH:21][c:22]1[n:23][nH:24][c:25]2[n:26][cH:27][n:28][c:29]([NH:31][c:32]3[cH:33][c:34]([Cl:38])[cH:35][cH:36][cH:37]3)[c:30]12

Participants

6

Reactant 5

HCID 702EthanolHCID 8028TetrahydrofuranHCID 62365Isobutyl chloroformateHCID 15162334HCID 15162334, compoundHCID 178509242HCID 178509242, compound

Product 1

HCID 178453816HCID 178453816, compound

Sources & evidence

ORD record
ord-889597e55d834ab1a10a67444c0b2daf
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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