Ethylbenzene → HCID 11339121, compound

HRID 1538957Notes

Reaction equation

HRID 1538957 reaction equation
[CH2:39]1[O:40][CH2:41][CH2:42][CH2:43]1.[CH2:44]1[O:45][CH2:46][CH2:47][CH2:48]1.[CH2:49]([c:50]1[cH:51][cH:52][cH:53][cH:54][cH:55]1)[CH3:56].[CH3:57][CH2:58][CH2:59][CH2:60][CH2:61][CH2:62][CH3:63].[CH:12]([N-:13][CH:14]([CH3:15])[CH3:16])([CH3:17])[CH3:18].[F:20][C:21]([C:22]([CH2:23][C:24]1([CH3:35])[CH2:25][CH2:26][O:27][c:28]2[cH:29][cH:30][c:31]([F:34])[cH:32][c:33]21)=[O:36])([F:37])[F:38].[Li+:19].[n:1]1[cH:2][cH:3][c:4]([CH3:5])[c:6]2[cH:7][cH:8][cH:9][cH:10][c:11]12>>[n:1]1[cH:2][cH:3][c:4]([CH2:5][C:22]([C:21]([F:20])([F:37])[F:38])([CH2:23][C:24]2([CH3:35])[CH2:25][CH2:26][O:27][c:28]3[cH:29][cH:30][c:31]([F:34])[cH:32][c:33]32)[OH:36])[c:6]2[cH:7][cH:8][cH:9][cH:10][c:11]12

Participants

8

Reactant 7

HCID 7500EthylbenzeneHCID 8028Tetrahydrofuran2×HCID 8900HeptaneHCID 102854-MethylquinolineHCID 28486Lithium ionHCID 5062348DiisopropylamideHCID 57809915HCID 57809915, compound

Product 1

HCID 11339121HCID 11339121, compound

Sources & evidence

ORD record
ord-18e4c5d84a66436c9f822adcea72ca4d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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