Hydrochloric Acid → HCID 68811208, compound

HRID 160589Notes

Reaction equation

HRID 160589 reaction equation
[CH2:50]1[O:51][CH2:52][CH2:53][O:54][CH2:55]1.[CH:27]([N:28]([CH2:29][CH3:30])[CH:31]([CH3:32])[CH3:33])([CH3:34])[CH3:35].[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][c:7]2[c:8]([CH:13]3[N:14]([C:18](=[O:19])[O:20][C:21]([CH3:22])([CH3:23])[CH3:24])[CH2:15][CH2:16][CH2:17]3)[n:9][n:10]([CH3:12])[cH:11]2)[cH:25][cH:26]1.[ClH:49].[N:36](=[C:37]=[O:38])[c:39]1[cH:40][cH:41][c:42]([C:45]([F:46])([F:47])[F:48])[cH:43][cH:44]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][c:7]2[c:8]([CH:13]3[N:14]([C:18](=[O:19])[NH:36][c:39]4[cH:40][cH:41][c:42]([C:45]([F:46])([F:47])[F:48])[cH:43][cH:44]4)[CH2:15][CH2:16][CH2:17]3)[n:9][n:10]([CH3:12])[cH:11]2)[cH:25][cH:26]1

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 312751,4-DioxaneHCID 737684-(Trifluoromethyl)phenyl isocyanateHCID 81531DiisopropylethylamineHCID 68835042HCID 68835042, compound

Product 1

HCID 68811208HCID 68811208, compound

Sources & evidence

ORD record
ord-670ad56af51c432b95c32159b324115b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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