Hydrochloric Acid → Hydrochloric Acid

HRID 1573153Notes

Reaction equation

HRID 1573153 reaction equation
[C:53]([O:54][BH-:55]([O:56][C:57](=[O:58])[CH3:59])[O:60][C:61](=[O:62])[CH3:63])(=[O:64])[CH3:65].[CH3:35][CH2:36][N:37]([CH2:38][CH3:39])[CH2:40][CH3:41].[CH3:76][OH:77].[CH:72]([Cl:73])([Cl:74])[Cl:75].[ClH:1].[ClH:2].[Na+:66].[Na+:71].[O-:67][C:68]([OH:69])=[O:70].[O:42]1[CH2:43][CH2:44][c:45]2[c:46]1[cH:47][cH:48][c:49]([CH:51]=[O:52])[cH:50]2.[s:3]1[c:4]2[cH:5][cH:6][c:7]([CH2:12][NH:13][CH:14]3[CH2:15][CH2:16][N:17]([CH2:20][CH:21]4[CH2:22][n:23]5[c:24](=[O:34])[cH:25][cH:26][c:27]6[cH:28][cH:29][c:30](=[O:33])[n:31]4[c:32]56)[CH2:18][CH2:19]3)[cH:8][c:9]2[n:10][n:11]1>>[CH2:12]([NH:13][CH:14]1[CH2:15][CH2:16][N:17]([CH2:20][CH:21]2[CH2:22][n:23]3[c:24](=[O:34])[cH:25][cH:26][c:27]4[cH:28][cH:29][c:30](=[O:33])[n:31]2[c:32]34)[CH2:18][CH2:19]1)[c:49]1[cH:48][cH:47][c:46]2[c:45]([cH:50]1)[CH2:44][CH2:43][O:42]2.[ClH:1]

Participants

11

Reactant 9

HCID 313Hydrochloric Acid2×HCID 769Bicarbonate IonHCID 887MethanolHCID 923Sodium ion2×HCID 6212ChloroformHCID 8471TriethylamineHCID 7359012,3-Dihydrobenzofuran-5-carboxaldehydeHCID 2724942TriacetoxyborohydrideHCID 178515660HCID 178515660, compound

Product 2

HCID 313Hydrochloric AcidHCID 77528902HCID 77528902, compound

Sources & evidence

ORD record
ord-2b6796d7c8e34a8ab64058fed45c1f9b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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