1,2-Dichloroethane → HCID 67441695, compound

HRID 1151293Notes

Reaction equation

HRID 1151293 reaction equation
[CH2:52]([Cl:53])[CH2:54][Cl:55].[CH:62]([Cl:63])([Cl:64])[Cl:65].[Cl:30][c:31]1[cH:32][cH:33][c:34]([CH2:37][C:38](=[O:39])[OH:40])[cH:35][cH:36]1.[ClH:56].[NH:1]1[CH2:2][CH:3]([NH:6][c:7]2[n:8][c:9]3[cH:10][cH:11][cH:12][cH:13][c:14]3[c:15]([N:17]3[CH2:18][CH2:19][N:20]([C:23](=[O:24])[O:25][C:26]([CH3:27])([CH3:28])[CH3:29])[CH2:21][CH2:22]3)[n:16]2)[CH2:4][CH2:5]1.[Na+:57].[OH2:51].[OH:41][n:42]1[c:43]2[c:44]([cH:45][cH:46][cH:47][cH:48]2)[n:49][n:50]1.[OH:58][C:59](=[O:60])[O-:61]>>[N:1]1([C:38]([CH2:37][c:34]2[cH:33][cH:32][c:31]([Cl:30])[cH:36][cH:35]2)=[O:39])[CH2:2][CH:3]([NH:6][c:7]2[n:8][c:9]3[cH:10][cH:11][cH:12][cH:13][c:14]3[c:15]([N:17]3[CH2:18][CH2:19][N:20]([C:23](=[O:24])[O:25][C:26]([CH3:27])([CH3:28])[CH3:29])[CH2:21][CH2:22]3)[n:16]2)[CH2:4][CH2:5]1

Participants

10

Reactant 9

HCID 111,2-DichloroethaneHCID 313Hydrochloric AcidHCID 769Bicarbonate IonHCID 923Sodium ionHCID 962WaterHCID 6212ChloroformHCID 15880(4-Chlorophenyl)acetic acidHCID 757711-HydroxybenzotriazoleHCID 67443573HCID 67443573, compound

Product 1

HCID 67441695HCID 67441695, compound

Sources & evidence

ORD record
ord-cbfe5f51af0b47a197cc03de2f56e639
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

Loading…