Hydrochloric Acid → HCID 178516094, compound

HRID 2335983Notes

Reaction equation

HRID 2335983 reaction equation
[C:24]1(=[O:31])[CH2:25][C:26](=[O:30])[CH2:27][CH2:28][CH2:29]1.[CH3:32][CH2:33][N:34]([CH2:35][CH3:36])[CH2:37][CH3:38].[CH3:39][C:40]([CH3:41])([OH:42])[C:43]#[N:44].[CH3:50][OH:51].[Cl:46][CH2:47][Cl:48].[ClH:45].[O:1]1[CH2:2][O:3][c:4]2[c:5]1[cH:6][cH:7][c:8](-[n:10]1[c:11](=[O:23])[c:12]([C:20](=[O:21])[Cl:22])[n:13][c:14]3[cH:15][cH:16][cH:17][cH:18][c:19]13)[cH:9]2.[OH2:49]>>[O:1]1[CH2:2][O:3][c:4]2[c:5]1[cH:6][cH:7][c:8](-[n:10]1[c:11](=[O:23])[c:12]([C:20](=[O:21])[C:25]3=[C:24]([OH:31])[CH2:29][CH2:28][CH2:27][C:26]3=[O:30])[n:13][c:14]3[cH:15][cH:16][cH:17][cH:18][c:19]13)[cH:9]2

Participants

9

Reactant 8

HCID 313Hydrochloric AcidHCID 887MethanolHCID 962WaterHCID 6344DichloromethaneHCID 6406Acetone CyanohydrinHCID 8471TriethylamineHCID 104341,3-CyclohexanedioneHCID 86643863HCID 86643863, compound

Product 1

HCID 178516094HCID 178516094, compound

Sources & evidence

ORD record
ord-08b2d825e9874a2eab7ef4fd9e4c4b15
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

Loading…