Hydrochloric Acid → HCID 58215676, compound

HRID 2333644Notes

Reaction equation

HRID 2333644 reaction equation
[CH2:67]1[O:68][CH2:69][CH2:70][CH2:71]1.[CH3:72][CH2:73][O:74][C:75](=[O:76])[CH3:77].[CH3:78][CH2:79][OH:80].[Cl:31][c:32]1[cH:33][cH:34][c:35]2[c:36]([C:61]#[N:62])[c:37](-[c:42]3[cH:43][n:44][cH:45][c:46]([CH:48]([CH3:49])[N:50]4[C:51](=[O:52])[c:53]5[c:54]([cH:55][cH:56][cH:57][cH:58]5)[C:59]4=[O:60])[cH:47]3)[n:38]([CH3:41])[c:39]2[cH:40]1.[ClH:66].[NH2:64][NH2:65].[O:1]=[C:2]1[c:3]2[c:4]([cH:5][cH:6][cH:7][cH:8]2)[C:9](=[O:10])[NH:11]1.[OH2:63].[c:12]1([P:13]([c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[cH:26][cH:27][cH:28][cH:29][cH:30]1>>[Cl:31][c:32]1[cH:33][cH:34][c:35]2[c:36]([C:61]#[N:62])[c:37](-[c:42]3[cH:43][n:44][cH:45][c:46]([CH:48]([CH3:49])[NH2:50])[cH:47]3)[n:38]([CH3:41])[c:39]2[cH:40]1

Participants

10

Reactant 9

HCID 313Hydrochloric AcidHCID 702EthanolHCID 962WaterHCID 6809PhthalimideHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 9321HydrazineHCID 11776TriphenylphosphineHCID 67093639HCID 67093639, compound

Product 1

HCID 58215676HCID 58215676, compound

Sources & evidence

ORD record
ord-daa64b4ab8594c2487c0d9daca83529b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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