Ethanol → Nitric Acid

HRID 1544866Notes

Reaction equation

HRID 1544866 reaction equation
[CH2:1]1[NH:2][CH2:3][C:4]2([O:5][c:6]3[c:7]([cH:9][cH:10][cH:11][cH:12]3)[CH2:8]2)[c:13]2[cH:14][cH:15][cH:16][cH:17][c:18]21.[CH3:23][C:24]1([C:30](=[NH:31])[NH2:32])[CH:25]=[C:26]([CH3:27])[N:28]=[N:29]1.[CH3:33][CH2:34][OH:35].[N+:19](=[O:20])([OH:21])[O-:22]>>[CH2:1]1[N:2]([C:30](=[NH:31])[NH2:32])[CH2:3][C:4]2([O:5][c:6]3[c:7]([cH:9][cH:10][cH:11][cH:12]3)[CH2:8]2)[c:13]2[cH:14][cH:15][cH:16][cH:17][c:18]21.[N+:19](=[O:20])([OH:21])[O-:22]

Participants

6

Reactant 4

HCID 702EthanolHCID 944Nitric AcidHCID 15917444spiro[benzofuran-2(3H),4'(2'H)-isoquinoline]HCID 218475073,5-Dimethylpyrazole-3-carboximidamide

Product 2

HCID 944Nitric AcidHCID 15917471spiro[1,3-dihydroisoquinoline-4,2'-3H-1-benzofuran]-2-carboximidamide

Sources & evidence

ORD record
ord-bde37ff618f349208749be43a248d515
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

Loading…