Acetone → HCID 68815874, compound

HRID 151670Notes

Reaction equation

HRID 151670 reaction equation
[Br:35][CH2:36][C:37]#[N:38].[CH3:1][n:2]1[c:3](-[c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)[c:4]([CH2:18][CH2:19][CH2:20][CH2:21][CH3:22])[c:5]2[cH:6][c:7](-[c:11]3[cH:12][cH:13][c:14]([OH:17])[cH:15][cH:16]3)[cH:8][cH:9][c:10]12.[CH3:39][C:40](=[O:41])[CH3:42].[K+:29].[K+:30].[O-:31][C:32]([O-:33])=[O:34]>>[CH3:1][n:2]1[c:3](-[c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)[c:4]([CH2:18][CH2:19][CH2:20][CH2:21][CH3:22])[c:5]2[cH:6][c:7](-[c:11]3[cH:12][cH:13][c:14]([O:17][CH2:36][C:37]#[N:38])[cH:15][cH:16]3)[cH:8][cH:9][c:10]12

Participants

6

Reactant 5

HCID 180AcetoneHCID 813Potassium Cation2×HCID 11534BromoacetonitrileHCID 19660Carbonate IonHCID 68814272HCID 68814272, compound

Product 1

HCID 68815874HCID 68815874, compound

Sources & evidence

ORD record
ord-f1cadf28081f45acb35f2a09e9f5f1e3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

Loading…