1,2-Dichloroethane → HCID 178463512, compound

HRID 1241181Notes

Reaction equation

HRID 1241181 reaction equation
[C:41]([O:42][BH-:43]([O:44][C:45](=[O:46])[CH3:47])[O:48][C:49](=[O:50])[CH3:51])(=[O:52])[CH3:53].[CH3:34][NH:35][CH3:36].[CH3:37][C:38](=[O:39])[OH:40].[CH3:59][CH2:60][O:61][C:62](=[O:63])[CH3:64].[Cl:55][CH2:56][CH2:57][Cl:58].[F:1][c:2]1[cH:3][cH:4][c:5]([CH:8]([CH3:9])[NH:10][c:11]2[n:12][c:13]([NH:22][c:23]3[n:24][cH:25][cH:26][n:27][cH:28]3)[cH:14][c:15]([N:17]3[CH2:18][C:19](=[O:21])[CH2:20]3)[n:16]2)[cH:6][cH:7]1.[Na+:54].[O:29]1[CH2:30][CH2:31][CH2:32][CH2:33]1>>[F:1][c:2]1[cH:3][cH:4][c:5]([CH:8]([CH3:9])[NH:10][c:11]2[n:12][c:13]([NH:22][c:23]3[n:24][cH:25][cH:26][n:27][cH:28]3)[cH:14][c:15]([N:17]3[CH2:18][CH:19]([N:35]([CH3:34])[CH3:36])[CH2:20]3)[n:16]2)[cH:6][cH:7]1

Participants

9

Reactant 8

HCID 111,2-DichloroethaneHCID 176Acetic AcidHCID 674DimethylamineHCID 923Sodium ionHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 2724942TriacetoxyborohydrideHCID 67007261HCID 67007261, compound

Product 1

HCID 178463512HCID 178463512, compound

Sources & evidence

ORD record
ord-33d83d4a7ac04315bff72a153141110d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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