Hydrochloric Acid → HCID 178523988, compound

HRID 2319902Notes

Reaction equation

HRID 2319902 reaction equation
[CH3:1][C:2]1([CH3:31])[O:3][CH2:4][CH:5]([CH2:7][O:8][NH:9][C:10](=[O:11])[c:12]2[c:13]([Cl:30])[c:14]3[n:15]([cH:16][n:17][cH:18][cH:19]3)[c:20]2[NH:21][c:22]2[c:23]([F:29])[cH:24][c:25]([I:28])[cH:26][cH:27]2)[O:6]1.[CH3:39][C:40]#[N:41].[CH3:42][OH:43].[CH3:44][CH2:45][O:46][C:47](=[O:48])[CH3:49].[ClH:32].[O:33]1[CH2:34][CH2:35][O:36][CH2:37][CH2:38]1>>[OH:3][CH2:4][CH:5]([OH:6])[CH2:7][O:8][NH:9][C:10](=[O:11])[c:12]1[c:13]([Cl:30])[c:14]2[n:15]([cH:16][n:17][cH:18][cH:19]2)[c:20]1[NH:21][c:22]1[c:23]([F:29])[cH:24][c:25]([I:28])[cH:26][cH:27]1

Participants

7

Reactant 6

HCID 313Hydrochloric AcidHCID 887MethanolHCID 6342AcetonitrileHCID 8857Ethyl AcetateHCID 312751,4-DioxaneHCID 178431460HCID 178431460, compound

Product 1

HCID 178523988HCID 178523988, compound

Sources & evidence

ORD record
ord-12d69c04d2214cbebdffe56f68c83ec4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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