1,2-Dichloroethane → HCID 22250846, compound

HRID 200413Notes

Reaction equation

HRID 200413 reaction equation
[C:30]([OH:31])(=[O:32])[CH3:33].[C:34]([BH3-:35])#[N:36].[Cl:41][CH2:42][CH2:43][Cl:44].[ClH:38].[F:21][c:22]1[cH:23][cH:24][c:25]([CH:26]=[O:27])[cH:28][cH:29]1.[Na+:37].[Na+:40].[OH-:39].[OH2:45].[c:1]1([CH:7]([CH:8]2[NH:9][CH2:10][CH:11]([NH2:14])[CH2:12][CH2:13]2)[c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH:7]([CH:8]2[NH:9][CH2:10][CH:11]([NH:14][CH2:26][c:25]3[cH:24][cH:23][c:22]([F:21])[cH:29][cH:28]3)[CH2:12][CH2:13]2)[c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

10

Reactant 9

HCID 111,2-DichloroethaneHCID 176Acetic AcidHCID 313Hydrochloric AcidHCID 923Sodium ion2×HCID 961HydroxideHCID 962WaterHCID 680234-FluorobenzaldehydeHCID 498716Cyano-borohydrideHCID 22250843HCID 22250843, compound

Product 1

HCID 22250846HCID 22250846, compound

Sources & evidence

ORD record
ord-17fe7cb7d86e42228e715e9e5a793f37
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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