Hydrochloric Acid → Hydrochloric Acid

HRID 109853

Reaction equation

HRID 109853 reaction equation
[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][c:6]1[cH:7][c:8]2[cH:9][cH:10][c:11]([C:16](=[O:17])[OH:18])[cH:12][c:13]2[cH:14][cH:15]1.[CH3:21][O:22][c:23]1[cH:24][c:25]([CH2:26][N:27]2[CH2:28][CH2:29][NH:30][CH2:31][CH2:32]2)[cH:33][c:34]([O:38][CH3:39])[c:35]1[O:36][CH3:37].[CH3:40][CH2:41][N:42]([CH2:43][CH3:44])[CH2:45][CH3:46].[CH3:57][N:58]([CH3:59])[CH:60]=[O:61].[ClH:19].[ClH:20].[P:47]([C:48]#[N:49])(=[O:50])([O:51][CH2:52][CH3:53])[O:54][CH2:55][CH3:56]>>[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][c:6]1[cH:7][c:8]2[cH:9][cH:10][c:11]([C:16](=[O:18])[N:30]3[CH2:29][CH2:28][N:27]([CH2:26][c:25]4[cH:24][c:23]([O:22][CH3:21])[c:35]([O:36][CH3:37])[c:34]([O:38][CH3:39])[cH:33]4)[CH2:32][CH2:31]3)[cH:12][c:13]2[cH:14][cH:15]1.[ClH:19]

Participants

8

Reactant 6

HCID 313Hydrochloric Acid2×HCID 6228DimethylformamideHCID 8471TriethylamineHCID 76257Diethyl cyanophosphonateHCID 1040951-[(3,4,5-Trimethoxyphenyl)methyl]piperazineHCID 11021128HCID 11021128, compound

Product 2

HCID 313Hydrochloric AcidHCID 14676155HCID 14676155, compound

Sources & evidence

ORD record
ord-670d2ccba7ad4bdbb51cf2d4c8c946d8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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