Hydrochloric Acid → 1-(4-Benzyloxyphenoxy)-3-[4-(2-methoxy-5-methylphenyl)-1-piperazinyl]propan-2-ol

HRID 97679

Reaction equation

HRID 97679 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][cH:11][c:12]([O:13][CH2:14][CH:15]2[CH2:16][O:17]2)[cH:18][cH:19]1.[CH3:28][O:29][c:30]1[c:31]([N:37]2[CH2:38][CH2:39][NH:40][CH2:41][CH2:42]2)[cH:32][c:33]([CH3:36])[cH:34][cH:35]1.[CH3:43][CH2:44][N:45]([CH2:46][CH3:47])[CH2:48][CH3:49].[ClH:26].[ClH:27].[O:20]1[CH2:21][CH2:22][O:23][CH2:24][CH2:25]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][cH:11][c:12]([O:13][CH2:14][CH:15]([CH2:16][N:40]2[CH2:39][CH2:38][N:37]([c:31]3[c:30]([O:29][CH3:28])[cH:35][cH:34][c:33]([CH3:36])[cH:32]3)[CH2:42][CH2:41]2)[OH:17])[cH:18][cH:19]1

Participants

6

Reactant 5

HCID 313Hydrochloric Acid2×HCID 8471TriethylamineHCID 312751,4-DioxaneHCID 119882((p-(Benzyloxy)phenoxy)methyl)oxiraneHCID 193571151-(2-Methoxy-5-methylphenyl)piperazine

Product 1

HCID 226254051-(4-Benzyloxyphenoxy)-3-[4-(2-methoxy-5-methylphenyl)-1-piperazinyl]propan-2-ol

Sources & evidence

ORD record
ord-72c00a28b6684ee3bb6cbac951c28bc2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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