1,2-Dichloroethane → HCID 58011937, compound

HRID 1224440Notes

Reaction equation

HRID 1224440 reaction equation
[CH2:45]([Cl:46])[CH2:47][Cl:48].[CH3:50][N:51]([CH3:52])[CH:53]=[O:54].[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9][n:10]([CH2:17][C:18](=[O:19])[OH:20])[c:11](=[O:16])[n:12]2[CH:13]2[CH2:14][CH2:15]2)[cH:6][cH:7]1.[ClH:49].[F:21][C:22]([c:23]1[cH:24][c:25]([C:29]([CH3:30])([CH3:31])[NH2:32])[cH:26][cH:27][cH:28]1)([F:33])[F:34].[OH:35][n:36]1[c:37]2[c:38]([cH:39][cH:40][cH:41][cH:42]2)[n:43][n:44]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9][n:10]([CH2:17][C:18](=[O:19])[NH:32][C:29]([c:25]3[cH:24][c:23]([C:22]([F:21])([F:33])[F:34])[cH:28][cH:27][cH:26]3)([CH3:30])[CH3:31])[c:11](=[O:16])[n:12]2[CH:13]2[CH2:14][CH2:15]2)[cH:6][cH:7]1

Participants

7

Reactant 6

HCID 111,2-DichloroethaneHCID 313Hydrochloric AcidHCID 6228DimethylformamideHCID 757711-HydroxybenzotriazoleHCID 194252732-[3-(Trifluoromethyl)phenyl]propan-2-amineHCID 42632357[3-(4-chlorophenyl)-4-cyclopropyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]acetic acid

Product 1

HCID 58011937HCID 58011937, compound

Sources & evidence

ORD record
ord-538457f1210645bdb9784b67f798a9e2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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