Formic Acid → HCID 10194168, compound

HRID 1125873Notes

Reaction equation

HRID 1125873 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[CH2:8][c:9]1[cH:10][cH:11][c:12]([O:15][C:16](=[O:17])[c:18]2[cH:19][c:20]3[c:25]([c:26]([C:28]#[CH:29])[cH:27]2)[O:24][C:23]([CH3:30])([CH3:31])[CH2:22][C:21]3([CH3:32])[CH3:33])[cH:13][cH:14]1.[CH2:37]1[O:38][CH2:39][CH2:40][O:41][CH2:42]1.[CH:34]([OH:35])=[O:36].[OH2:43]>>[O:5]=[C:6]([OH:7])[CH2:8][c:9]1[cH:10][cH:11][c:12]([O:15][C:16](=[O:17])[c:18]2[cH:19][c:20]3[c:25]([c:26]([C:28]#[CH:29])[cH:27]2)[O:24][C:23]([CH3:30])([CH3:31])[CH2:22][C:21]3([CH3:32])[CH3:33])[cH:13][cH:14]1

Participants

5

Reactant 4

HCID 284Formic AcidHCID 962WaterHCID 312751,4-DioxaneHCID 12137003HCID 12137003, compound

Product 1

HCID 10194168HCID 10194168, compound

Sources & evidence

ORD record
ord-3a2f1f447593448abf7131f304aa2f67
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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