Water → HCID 178518018, compound

HRID 2150262Notes

Reaction equation

HRID 2150262 reaction equation
[CH3:37][S:38][c:39]1[c:40]2[c:41]([n:42][c:43]([OH:45])[n:44]1)[nH:46][n:47][cH:48]2.[CH3:50][CH:51]([OH:52])[CH3:53].[F:19][CH:20]([c:21]1[cH:22][cH:23][cH:24][cH:25][c:26]1[F:27])[CH2:28][O:29][CH:30]1[CH2:31][CH2:32][CH:33]([NH2:34])[CH2:35][CH2:36]1.[F:1][CH:2]([CH2:3][O:4][CH:5]1[CH2:6][CH2:7][CH:8]([NH2:11])[CH2:9][CH2:10]1)[c:12]1[c:13]([F:18])[cH:14][cH:15][cH:16][cH:17]1.[OH2:49]>>[F:1][CH:2]([CH2:3][O:4][CH:5]1[CH2:6][CH2:7][CH:8]([NH:11][c:39]2[c:40]3[c:41]([n:42][c:43]([OH:45])[n:44]2)[nH:46][n:47][cH:48]3)[CH2:9][CH2:10]1)[c:12]1[c:13]([F:18])[cH:14][cH:15][cH:16][cH:17]1

Participants

5

Reactant 4

HCID 962WaterHCID 3776IsopropanolHCID 58812731trans-4-[2-Fluoro-2-(2-fluorophenyl)ethoxy]cyclohexanamine2×HCID 178503571HCID 178503571, compound

Product 1

HCID 178518018HCID 178518018, compound

Sources & evidence

ORD record
ord-3eeb205e5e794230acd445b2829ecea3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

Loading…