Toluene → HCID 59351518, compound

HRID 1551828Notes

Reaction equation

HRID 1551828 reaction equation
[CH3:1][O:2][c:3]1[cH:4][c:5]([O:39][CH3:40])[cH:41][cH:42][c:43]1[CH2:44][n:6]1[c:7](=[O:38])[n:8]([CH2:21][c:22]2[c:23]([F:37])[cH:24][c:25](-[c:29]3[c:30]([C:35]#[N:36])[cH:31][cH:32][cH:33][cH:34]3)[cH:26][c:27]2[F:28])[c:9]2[c:10]([c:11]1=[O:12])[cH:13][c:14]([CH2:16][C:17]([F:18])([F:19])[F:20])[s:15]2.[CH3:52][c:53]1[cH:54][cH:55][cH:56][cH:57][cH:58]1.[OH:45][C:46]([C:47]([F:48])([F:49])[F:50])=[O:51]>>[nH:6]1[c:7](=[O:38])[n:8]([CH2:21][c:22]2[c:23]([F:37])[cH:24][c:25](-[c:29]3[c:30]([C:35]#[N:36])[cH:31][cH:32][cH:33][cH:34]3)[cH:26][c:27]2[F:28])[c:9]2[c:10]([c:11]1=[O:12])[cH:13][c:14]([CH2:16][C:17]([F:18])([F:19])[F:20])[s:15]2

Participants

4

Reactant 3

HCID 1140TolueneHCID 6422Trifluoroacetic acidHCID 59351714HCID 59351714, compound

Product 1

HCID 59351518HCID 59351518, compound

Sources & evidence

ORD record
ord-59ee73f40f9d41d7bac99d96d9b45a40
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

Loading…