Acetic Acid → HCID 19380415, compound

HRID 2316310Notes

Reaction equation

HRID 2316310 reaction equation
[CH3:33][C:34](=[O:35])[OH:36].[O:1]1[CH:2]([CH2:6][CH2:7][CH:8]2[CH2:9][CH2:10][CH:11]([CH:14]3[CH2:15][CH2:16][CH:17]([c:20]4[cH:21][cH:22][c:23]([F:26])[cH:24][cH:25]4)[CH2:18][CH2:19]3)[CH2:12][CH2:13]2)[O:5][CH2:4][CH2:3]1.[O:27]1[CH2:28][CH2:29][O:30][CH2:31][CH2:32]1.[OH2:37]>>[O:1]=[CH:2][CH2:6][CH2:7][CH:8]1[CH2:9][CH2:10][CH:11]([CH:14]2[CH2:15][CH2:16][CH:17]([c:20]3[cH:21][cH:22][c:23]([F:26])[cH:24][cH:25]3)[CH2:18][CH2:19]2)[CH2:12][CH2:13]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 962WaterHCID 312751,4-DioxaneHCID 19380453HCID 19380453, compound

Product 1

HCID 19380415HCID 19380415, compound

Sources & evidence

ORD record
ord-52bbc4c8392d4c9eb2e7e45c8450e7e5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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