Toluene → HCID 72259612, compound

HRID 2151550Notes

Reaction equation

HRID 2151550 reaction equation
[CH2:42]([P:43]([CH2:44][CH2:45][CH2:46][CH3:47])[CH2:48][CH2:49][CH2:50][CH3:51])[CH2:52][CH2:53][CH3:54].[CH3:16][c:17]1[c:18](-[c:34]2[cH:35][c:36]([CH2:40][OH:41])[cH:37][cH:38][cH:39]2)[c:19]([CH3:33])[c:20]([CH3:32])[c:21]([O:24][CH2:25][CH2:26][CH2:27][S:28](=[O:29])(=[O:30])[CH3:31])[c:22]1[CH3:23].[CH3:73][c:74]1[cH:75][cH:76][cH:77][cH:78][cH:79]1.[CH3:80][CH2:81][CH2:82][CH2:83][CH2:84][CH3:85].[N:55]([C:56]([N:57]1[CH2:58][CH2:59][CH2:60][CH2:61][CH2:62]1)=[O:63])=[N:64][C:65]([N:66]1[CH2:67][CH2:68][CH2:69][CH2:70][CH2:71]1)=[O:72].[OH:1][c:2]1[cH:3][c:4]2[c:5]([cH:14][cH:15]1)[CH:6]([CH2:9][C:10](=[O:11])[O:12][CH3:13])[CH2:7][O:8]2>>[O:1]([c:2]1[cH:3][c:4]2[c:5]([cH:14][cH:15]1)[CH:6]([CH2:9][C:10](=[O:11])[O:12][CH3:13])[CH2:7][O:8]2)[CH2:40][c:36]1[cH:35][c:34](-[c:18]2[c:17]([CH3:16])[c:22]([CH3:23])[c:21]([O:24][CH2:25][CH2:26][CH2:27][S:28](=[O:29])(=[O:30])[CH3:31])[c:20]([CH3:32])[c:19]2[CH3:33])[cH:39][cH:38][cH:37]1

Participants

7

Reactant 6

HCID 1140TolueneHCID 8058HexaneHCID 13831TributylphosphineHCID 730421,1'-(Azodicarbonyl)dipiperidineHCID 57345855Methyl 2-(6-hydroxy-2,3-dihydrobenzofuran-3-yl)acetateHCID 59342583{2',3',5',6'-Tetramethyl-4'-[3-(methylsulfonyl)propoxy]biphenyl-3-yl}methanol

Product 1

HCID 72259612HCID 72259612, compound

Sources & evidence

ORD record
ord-b7d57e8a65fa48d495aed00bbfa0e4fc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

Loading…