4-Chlorophenol → HCID 67046320, compound

HRID 288252Notes

Reaction equation

HRID 288252 reaction equation
[CH2:33]([P:34]([CH2:35][CH2:36][CH2:37][CH3:38])[CH2:39][CH2:40][CH2:41][CH3:42])[CH2:43][CH2:44][CH3:45].[Cl:25][c:26]1[cH:27][cH:28][c:29]([OH:32])[cH:30][cH:31]1.[N:46]([C:47]([N:48]1[CH2:49][CH2:50][CH2:51][CH2:52][CH2:53]1)=[O:54])=[N:55][C:56]([N:57]1[CH2:58][CH2:59][CH2:60][CH2:61][CH2:62]1)=[O:63].[O:64]1[CH2:65][CH2:66][CH2:67][CH2:68]1.[c:1]1([CH3:24])[cH:2][cH:3][c:4](-[c:7]2[n:8][c:9]3[n:10]([cH:11][c:12](-[c:15]4[cH:16][c:17]([CH2:21][OH:22])[cH:18][cH:19][cH:20]4)[cH:13][cH:14]3)[cH:23]2)[cH:5][cH:6]1>>[c:1]1([CH3:24])[cH:2][cH:3][c:4](-[c:7]2[n:8][c:9]3[n:10]([cH:11][c:12](-[c:15]4[cH:16][c:17]([CH2:21][O:22][c:29]5[cH:28][cH:27][c:26]([Cl:25])[cH:31][cH:30]5)[cH:18][cH:19][cH:20]4)[cH:13][cH:14]3)[cH:23]2)[cH:5][cH:6]1

Participants

6

Reactant 5

HCID 46844-ChlorophenolHCID 8028TetrahydrofuranHCID 13831TributylphosphineHCID 730421,1'-(Azodicarbonyl)dipiperidineHCID 24856033HCID 24856033, compound

Product 1

HCID 67046320HCID 67046320, compound

Sources & evidence

ORD record
ord-febf5b436351450fa28dbdc3c2a08b57
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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