1,2-Dichloroethane → HCID 69336907, compound

HRID 123548Notes

Reaction equation

HRID 123548 reaction equation
[C:31]([O:32][BH-:33]([O:34][C:35](=[O:36])[CH3:37])[O:38][C:39](=[O:40])[CH3:41])(=[O:42])[CH3:43].[CH3:11][N:12]([C:13]1([c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[CH2:14][CH2:15][C:16](=[O:19])[CH2:17][CH2:18]1)[CH3:26].[CH3:27][C:28](=[O:29])[OH:30].[Cl:45][CH2:46][CH2:47][Cl:48].[NH2:1][c:2]1[cH:3][c:4]2[c:5]([n:6][cH:7][s:8]2)[cH:9][cH:10]1.[Na+:44]>>[NH:1]([c:2]1[cH:3][c:4]2[c:5]([n:6][cH:7][s:8]2)[cH:9][cH:10]1)[CH:16]1[CH2:15][CH2:14][C:13]([N:12]([CH3:11])[CH3:26])([c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[CH2:18][CH2:17]1

Participants

7

Reactant 6

HCID 111,2-DichloroethaneHCID 176Acetic AcidHCID 923Sodium ionHCID 682886-AminobenzothiazoleHCID 2724942TriacetoxyborohydrideHCID 114244924-(Dimethylamino)-4-phenylcyclohexan-1-one

Product 1

HCID 69336907HCID 69336907, compound

Sources & evidence

ORD record
ord-ea4ecbf548514bceb4dfa136053c2067
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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