Acetic Acid → HCID 86632300, compound

HRID 1535098Notes

Reaction equation

HRID 1535098 reaction equation
[CH3:24][C:25](=[O:26])[OH:27].[Cl:1][c:2]1[c:3]([CH3:21])[c:4]([CH3:20])[c:5]([CH:8]([c:9]2[cH:10][cH:11][c:12]([F:17])[c:13]([C:14]#[N:15])[cH:16]2)[C:18]#[N:19])[n:6][n:7]1.[ClH:22].[OH2:23]>>[Cl:1][c:2]1[c:3]([CH3:21])[c:4]([CH3:20])[c:5]([CH2:8][c:9]2[cH:10][cH:11][c:12]([F:17])[c:13]([C:14]#[N:15])[cH:16]2)[n:6][n:7]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 313Hydrochloric AcidHCID 962WaterHCID 86646539HCID 86646539, compound

Product 1

HCID 86632300HCID 86632300, compound

Sources & evidence

ORD record
ord-916500ea51f74d14adc5550cf18c0903
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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