Hexane → HCID 58847326, compound

HRID 1571795Notes

Reaction equation

HRID 1571795 reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]([C:8]([F:9])([F:10])[F:11])[cH:6][cH:7]1.[CH3:12][O:13][c:14]1[cH:15][cH:16][c:17]([N:20]2[CH2:21][CH2:22][N:23]([c:26]3[c:27]([CH3:40])[c:28]([CH3:39])[c:29]4[c:30]([c:37]3[CH3:38])[C:31](=[O:36])[C:32]([CH3:34])([CH3:35])[O:33]4)[CH2:24][CH2:25]2)[cH:18][cH:19]1.[CH3:41][CH2:42][CH2:43][CH2:44][CH2:45][CH3:46]>>[c:2]1([C:31]2([OH:36])[c:30]3[c:29]([c:28]([CH3:39])[c:27]([CH3:40])[c:26]([N:23]4[CH2:22][CH2:21][N:20]([c:17]5[cH:16][cH:15][c:14]([O:13][CH3:12])[cH:19][cH:18]5)[CH2:25][CH2:24]4)[c:37]3[CH3:38])[O:33][C:32]2([CH3:34])[CH3:35])[cH:3][cH:4][c:5]([C:8]([F:9])([F:10])[F:11])[cH:6][cH:7]1

Participants

4

Reactant 3

HCID 8058HexaneHCID 67872Benzene, 1-bromo-4-(trifluoromethyl)-HCID 229355955-[4-(4-methoxyphenyl)piperazin-1-yl]-2,2,4,6,7-pentamethyl-1-benzofuran-3(2H)-one

Product 1

HCID 58847326HCID 58847326, compound

Sources & evidence

ORD record
ord-6a7cd9720cdb439aa3dad244845810b7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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