1,2-Dichloroethane → HCID 68959011, compound

HRID 295364Notes

Reaction equation

HRID 295364 reaction equation
[C:5]([CH3:6])([CH3:7])([CH3:8])[O:9][C:10](=[O:11])[NH:12][CH:13]([CH:14]([C:15](=[O:16])[OH:17])[OH:18])[CH2:19][CH2:20][CH3:21].[CH2:22]([Cl:23])[CH2:24][Cl:25].[CH3:32][CH2:33][O:34][C:35](=[O:36])[CH3:37].[CH:1]1([NH2:4])[CH2:2][CH2:3]1.[ClH:26].[Na+:31].[O-:27][C:28]([OH:29])=[O:30].[OH2:38]>>[CH:1]1([NH:4][C:15]([CH:14]([CH:13]([NH:12][C:10]([O:9][C:5]([CH3:6])([CH3:7])[CH3:8])=[O:11])[CH2:19][CH2:20][CH3:21])[OH:18])=[O:16])[CH2:2][CH2:3]1

Participants

9

Reactant 8

HCID 111,2-DichloroethaneHCID 313Hydrochloric AcidHCID 769Bicarbonate IonHCID 923Sodium ionHCID 962WaterHCID 8857Ethyl AcetateHCID 69828CyclopropylamineHCID 11572336Hexanoic acid, 3-[[(1,1-dimethylethoxy)carbonyl]amino]-2-hydroxy-

Product 1

HCID 68959011HCID 68959011, compound

Sources & evidence

ORD record
ord-e9952b6a26e2491a8d259d9bf6f7b9de
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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