Acetone → HCID 15665147, compound

HRID 2328015Notes

Reaction equation

HRID 2328015 reaction equation
[C:43](=[O:44])([OH:45])[O-:46].[CH3:1][C:2]1=[C:7]([C:8](=[O:9])[O:10][CH2:11][CH2:12][O:13][CH2:14][c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)[CH:6]([c:21]2[cH:22][c:23]([N+:27](=[O:28])[O-:29])[cH:24][cH:25][cH:26]2)[C:5]([C:30](=[O:31])[O:32][CH2:33][CH3:34])=[C:4]([CH:35]([O:36][CH2:40][CH3:41])[O:37][CH2:38][CH3:39])[NH:3]1.[CH3:48][C:49](=[O:50])[CH3:51].[ClH:42].[Na+:47]>>[CH3:1][C:2]1=[C:7]([C:8](=[O:9])[O:10][CH2:11][CH2:12][O:13][CH2:14][c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)[CH:6]([c:21]2[cH:22][c:23]([N+:27](=[O:28])[O-:29])[cH:24][cH:25][cH:26]2)[C:5]([C:30](=[O:31])[O:32][CH2:33][CH3:34])=[C:4]([CH:35]=[O:36])[NH:3]1

Participants

6

Reactant 5

HCID 180AcetoneHCID 313Hydrochloric AcidHCID 769Bicarbonate IonHCID 923Sodium ionHCID 15665137HCID 15665137, compound

Product 1

HCID 15665147HCID 15665147, compound

Sources & evidence

ORD record
ord-c303fba85a694196ac04a2518f2e9976
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

Loading…