Toluene → HCID 15467448, compound

HRID 1563983Notes

Reaction equation

HRID 1563983 reaction equation
[C:83]([CH3:84])(=[O:85])[Br:86].[CH2:93]([Cl:94])[Cl:95].[CH3:63][Al:64]([CH3:65])[CH3:66].[CH3:67][c:68]1[cH:69][cH:70][cH:71][cH:72][cH:73]1.[CH:74]([N:75]([CH2:76][CH3:77])[CH:78]([CH3:79])[CH3:80])([CH3:81])[CH3:82].[CH:87]([CH2:88][CH:89]([CH3:90])[CH3:91])=[O:92].[F:1][C:2]([F:3])([F:4])[S:5]([NH:6][CH:7]([CH:8]([CH3:9])[CH3:10])[CH2:11][N:12]([CH2:13][c:14]1[cH:15][cH:16][cH:17][c:18]([CH2:19][N:20]([CH2:21][CH:22]([CH:23]([CH3:24])[CH3:25])[NH:26][S:27]([C:28]([F:29])([F:30])[F:31])(=[O:32])=[O:33])[CH2:34][CH:35]([CH:36]([CH3:37])[CH3:38])[NH:39][S:40]([C:41]([F:42])([F:43])[F:44])(=[O:45])=[O:46])[cH:47]1)[CH2:48][CH:49]([CH:50]([CH3:51])[CH3:52])[NH:53][S:54]([C:55]([F:56])([F:57])[F:58])(=[O:59])=[O:60])(=[O:61])=[O:62]>>[C:83]1(=[O:85])[CH2:84][CH:87]([CH2:88][CH:89]([CH3:90])[CH3:91])[O:92]1

Participants

8

Reactant 7

HCID 1140TolueneHCID 6344DichloromethaneHCID 10482Acetyl bromideHCID 115523-MethylbutanalHCID 81531DiisopropylethylamineHCID 16682925TrimethylaluminumHCID 178446321HCID 178446321, compound

Product 1

HCID 15467448HCID 15467448, compound

Sources & evidence

ORD record
ord-7ac6428ef607426a823a7268925933cb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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