1,2-Dichloroethane → HCID 21201536, compound

HRID 1131078Notes

Reaction equation

HRID 1131078 reaction equation
[C:54](=[O:55])([OH:56])[O-:57].[C:8]([CH3:9])([CH3:10])([CH3:11])[O:12][C:13](=[O:14])[CH2:15][N:16]1[C:17](=[O:50])[CH:18]([NH:33][C:34](=[O:35])[NH:36][c:37]2[cH:38][c:39]([C:43](=[O:44])[NH:45][S:46](=[O:47])(=[O:48])[CH3:49])[cH:40][cH:41][cH:42]2)[CH2:19][N:20]([c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[c:21]2[c:22]1[cH:23][cH:24][cH:25][cH:26]2.[CH2:51]([Cl:52])[Cl:53].[Cl:59][CH2:60][CH2:61][Cl:62].[Na+:58].[OH:1][C:2]([C:3]([F:4])([F:5])[F:6])=[O:7]>>[O:12]=[C:13]([OH:14])[CH2:15][N:16]1[C:17](=[O:50])[CH:18]([NH:33][C:34](=[O:35])[NH:36][c:37]2[cH:38][c:39]([C:43](=[O:44])[NH:45][S:46](=[O:47])(=[O:48])[CH3:49])[cH:40][cH:41][cH:42]2)[CH2:19][N:20]([c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[c:21]2[c:22]1[cH:23][cH:24][cH:25][cH:26]2

Participants

7

Reactant 6

HCID 111,2-DichloroethaneHCID 769Bicarbonate IonHCID 923Sodium ionHCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 21201549HCID 21201549, compound

Product 1

HCID 21201536HCID 21201536, compound

Sources & evidence

ORD record
ord-be045fbf3bfe44d7aef16b1066cf996c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

Loading…