Water → HCID 15230643, compound

HRID 2161382Notes

Reaction equation

HRID 2161382 reaction equation
[CH2:28]([Li:29])[CH2:30][CH2:31][CH3:32].[F:33][c:34]1[c:35]([N:41]=[C:42]=[O:43])[cH:36][cH:37][c:38]([F:40])[cH:39]1.[O:45]1[CH2:46][CH2:47][CH2:48][CH2:49]1.[OH2:44].[c:1]1([NH:7][c:8]2[n:9][n:10][n:11]([CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][O:21][CH:22]3[O:23][CH2:24][CH2:25][CH2:26][CH2:27]3)[n:12]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([N:7]([c:8]2[n:9][n:10][n:11]([CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][O:21][CH:22]3[O:23][CH2:24][CH2:25][CH2:26][CH2:27]3)[n:12]2)[C:42]([NH:41][c:35]2[c:34]([F:33])[cH:39][c:38]([F:40])[cH:37][cH:36]2)=[O:43])[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

6

Reactant 5

HCID 962WaterHCID 8028TetrahydrofuranHCID 5932582,4-Difluorophenyl isocyanateHCID 18957150HCID 18957150, compoundHCID 178418339Butyllithium

Product 1

HCID 15230643HCID 15230643, compound

Sources & evidence

ORD record
ord-b720e3fae63644e384bad6dab48f74bb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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