1,2-Dichloroethane → HCID 67243173, compound

HRID 686393Notes

Reaction equation

HRID 686393 reaction equation
[CH3:25][CH2:26][N:27]([CH2:28][CH3:29])[CH2:30][CH3:31].[Cl:46][CH2:47][CH2:48][Cl:49].[NH2:1][CH2:2][CH2:3][CH2:4][NH:5][CH:6]1[CH2:7][N:8]([S:11](=[O:12])(=[O:13])[c:14]2[c:15]3[c:16]([CH3:24])[cH:17][n:18][cH:19][c:20]3[cH:21][cH:22][cH:23]2)[CH2:9][CH2:10]1.[Na+:41].[O:32]=[C:33]=[N:34][c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1.[OH:42][C:43](=[O:44])[O-:45]>>[NH:1]([CH2:2][CH2:3][CH2:4][NH:5][CH:6]1[CH2:7][N:8]([S:11](=[O:12])(=[O:13])[c:14]2[c:15]3[c:16]([CH3:24])[cH:17][n:18][cH:19][c:20]3[cH:21][cH:22][cH:23]2)[CH2:9][CH2:10]1)[C:33](=[O:32])[NH:34][c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1

Participants

7

Reactant 6

HCID 111,2-DichloroethaneHCID 769Bicarbonate IonHCID 923Sodium ionHCID 7672Phenyl isocyanateHCID 8471TriethylamineHCID 67242428HCID 67242428, compound

Product 1

HCID 67243173HCID 67243173, compound

Sources & evidence

ORD record
ord-b5a60980af704c919480781954860eaf
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

Loading…