Acetic Acid → HCID 66998231, compound

HRID 673977Notes

Reaction equation

HRID 673977 reaction equation
[CH3:33][OH:34].[CH3:35][C:36](=[O:37])[OH:38].[N:1](=[N+:2]=[N-:3])[CH2:4][c:5]1[n:6][c:7](-[c:10]2[cH:11][c:12]3[c:13]4[c:14]([n:15]([CH3:19])[c:16]3[cH:17][cH:18]2)[n:20]([CH3:32])[c:21](=[O:31])[c:22](-[c:24]2[cH:25][cH:26][c:27]([Br:30])[cH:28][cH:29]2)[cH:23]4)[s:8][cH:9]1>>[NH2:1][CH2:4][c:5]1[n:6][c:7](-[c:10]2[cH:11][c:12]3[c:13]4[c:14]([n:15]([CH3:19])[c:16]3[cH:17][cH:18]2)[n:20]([CH3:32])[c:21](=[O:31])[c:22](-[c:24]2[cH:25][cH:26][c:27]([Br:30])[cH:28][cH:29]2)[cH:23]4)[s:8][cH:9]1

Participants

4

Reactant 3

HCID 176Acetic AcidHCID 887MethanolHCID 86623952HCID 86623952, compound

Product 1

HCID 66998231HCID 66998231, compound

Sources & evidence

ORD record
ord-54aa5d6160ce4118809f8ca1ee9791aa
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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