1,2-Dichloroethane → HCID 69341667, compound

HRID 180070Notes

Reaction equation

HRID 180070 reaction equation
[C:38]([O:39][BH-:40]([O:41][C:42](=[O:43])[CH3:44])[O:45][C:46](=[O:47])[CH3:48])(=[O:49])[CH3:50].[CH3:52][C:53](=[O:54])[OH:55].[CH:1]([CH2:2][CH3:3])=[O:4].[CH:5]1([NH:11][c:12]2[cH:13][c:14]([CH:18]([c:19]3[cH:20][cH:21][c:22]([C:23](=[O:24])[N:25]([CH2:26][CH3:27])[CH2:28][CH3:29])[cH:30][cH:31]3)[N:32]3[CH2:33][CH2:34][NH:35][CH2:36][CH2:37]3)[cH:15][cH:16][cH:17]2)[CH2:6][CH2:7][CH2:8][CH2:9][CH2:10]1.[Cl:56][CH2:57][CH2:58][Cl:59].[Na+:51]>>[CH2:1]([CH2:2][CH3:3])[N:35]1[CH2:34][CH2:33][N:32]([CH:18]([c:14]2[cH:13][c:12]([NH:11][CH:5]3[CH2:6][CH2:7][CH2:8][CH2:9][CH2:10]3)[cH:17][cH:16][cH:15]2)[c:19]2[cH:20][cH:21][c:22]([C:23](=[O:24])[N:25]([CH2:26][CH3:27])[CH2:28][CH3:29])[cH:30][cH:31]2)[CH2:37][CH2:36]1

Participants

7

Reactant 6

HCID 111,2-DichloroethaneHCID 176Acetic AcidHCID 527PropanalHCID 923Sodium ionHCID 2724942TriacetoxyborohydrideHCID 69341323HCID 69341323, compound

Product 1

HCID 69341667HCID 69341667, compound

Sources & evidence

ORD record
ord-f99908a8f2484d37901f1ccf81c05c2e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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