Ethyl isocyanate → HCID 68547768, compound

HRID 206383Notes

Reaction equation

HRID 206383 reaction equation
[CH2:1]([CH3:2])[N:3]=[C:4]=[O:5].[CH3:37][N:38]([c:39]1[cH:40][cH:41][n:42][cH:43][cH:44]1)[CH3:45].[CH3:6][O:7][C:8](=[O:9])[c:10]1[c:11]([O:30][CH2:31][C:32](=[O:33])[O:34][CH2:35][CH3:36])[c:12]2[c:13]([c:14]3[cH:15][cH:16][cH:17][c:18]([NH:21][CH2:22][CH:23]4[CH2:24][CH2:25][CH2:26][CH2:27][CH2:28]4)[c:19]3[s:20]2)[s:29]1>>[CH2:1]([CH3:2])[NH:3][C:4](=[O:5])[N:21]([c:18]1[cH:17][cH:16][cH:15][c:14]2[c:13]3[c:12]([c:11]([O:30][CH2:31][C:32](=[O:33])[O:34][CH2:35][CH3:36])[c:10]([C:8]([O:7][CH3:6])=[O:9])[s:29]3)[s:20][c:19]21)[CH2:22][CH:23]1[CH2:24][CH2:25][CH2:26][CH2:27][CH2:28]1

Participants

4

Reactant 3

HCID 8022Ethyl isocyanateHCID 142844-(Dimethylamino)pyridineHCID 68548829HCID 68548829, compound

Product 1

HCID 68547768HCID 68547768, compound

Sources & evidence

ORD record
ord-e2e4a625788b49ec8a55a42c3a9adba6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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