Acetic Acid → HCID 178421137, compound

HRID 700419Notes

Reaction equation

HRID 700419 reaction equation
[CH3:1][S:2]([O:3][CH:6]1[CH:7]([O:4][S:5]([CH3:27])(=[O:28])=[O:29])[CH:8]2[CH:9]3[CH2:10][CH2:11][C:12](=[O:26])[C:13]3([CH3:14])[CH2:15][CH2:16][CH:17]2[C:18]2([CH3:25])[CH2:19][CH2:20][C:21](=[O:24])[CH:22]=[C:23]12)(=[O:30])=[O:31].[CH3:36][C:37](=[O:38])[OH:39].[CH3:40][OH:41].[N-:33]=[N+:34]=[N-:35].[Na+:32]>>[C:6]1([N:33]=[N+:34]=[N-:35])=[CH:7][CH:8]2[CH:9]3[CH2:10][CH2:11][C:12](=[O:26])[C:13]3([CH3:14])[CH2:15][CH2:16][CH:17]2[C:18]2([CH3:25])[CH2:19][CH2:20][C:21](=[O:24])[CH:22]=[C:23]12

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 887MethanolHCID 923Sodium ionHCID 33558AzideHCID 178421177HCID 178421177, compound

Product 1

HCID 178421137HCID 178421137, compound

Sources & evidence

ORD record
ord-fb53f7a97acb4169ad69ff911c996483
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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