Nitromethane → HCID 57835770, compound

HRID 1123454Notes

Reaction equation

HRID 1123454 reaction equation
[CH3:1][N:2]([CH3:3])[C:4]([N:5]([CH3:6])[CH3:7])=[NH:8].[CH3:9][O:10][c:11]1[cH:12][cH:13][c:14]([CH2:15][O:16][c:17]2[cH:18][cH:19][c:20]([CH:23]=[CH:24][C:25](=[O:26])[O:27][CH2:28][c:29]3[cH:30][cH:31][c:32]([O:35][CH3:36])[cH:33][cH:34]3)[cH:21][cH:22]2)[cH:37][cH:38]1.[N+:39](=[O:40])([O-:41])[CH3:42]>>[CH3:9][O:10][c:11]1[cH:12][cH:13][c:14]([CH2:15][O:16][c:17]2[cH:18][cH:19][c:20]([CH:23]([CH2:24][C:25](=[O:26])[O:27][CH2:28][c:29]3[cH:30][cH:31][c:32]([O:35][CH3:36])[cH:33][cH:34]3)[CH2:42][N+:39](=[O:40])[O-:41])[cH:21][cH:22]2)[cH:37][cH:38]1

Participants

4

Reactant 3

HCID 6375NitromethaneHCID 664601,1,3,3-TetramethylguanidineHCID 66685582HCID 66685582, compound

Product 1

HCID 57835770HCID 57835770, compound

Sources & evidence

ORD record
ord-4baafc75c5974ef0ad57fe0abd486133
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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