1,2-Dichloroethane → HCID 21471614, compound

HRID 191557Notes

Reaction equation

HRID 191557 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][C:11](=[O:14])[CH2:12][CH2:13]1.[C:32]([O:33][BH-:34]([O:35][C:36](=[O:37])[CH3:38])[O:39][C:40](=[O:41])[CH3:42])(=[O:43])[CH3:44].[C:46](=[O:47])([O-:48])[O-:49].[CH3:15][c:16]1[cH:17][c:18]2[c:19]([n:20]([CH:24]3[CH2:25][CH2:26][NH:27][CH2:28][CH2:29]3)[c:21](=[O:23])[nH:22]2)[cH:30][cH:31]1.[CH3:56][C:57](=[O:58])[OH:59].[CH:52]([Cl:53])([Cl:54])[Cl:55].[Cl:60][CH2:61][CH2:62][Cl:63].[Na+:45].[Na+:50].[Na+:51]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([N:27]2[CH2:26][CH2:25][CH:24]([n:20]3[c:19]4[c:18]([cH:17][c:16]([CH3:15])[cH:31][cH:30]4)[nH:22][c:21]3=[O:23])[CH2:29][CH2:28]2)[CH2:12][CH2:13]1

Participants

9

Reactant 8

HCID 111,2-DichloroethaneHCID 176Acetic AcidHCID 923Sodium ion3×HCID 6212ChloroformHCID 19660Carbonate IonHCID 735900tert-Butyl 4-oxopiperidine-1-carboxylateHCID 2724942TriacetoxyborohydrideHCID 13792103HCID 13792103, compound

Product 1

HCID 21471614HCID 21471614, compound

Sources & evidence

ORD record
ord-69ec53c3edf944ce8f0e1e1cc8b52cc4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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