1,2-Dichloroethane → HCID 18542514, compound

HRID 190155Notes

Reaction equation

HRID 190155 reaction equation
[C:37]([O:38][BH-:39]([O:40][C:41](=[O:42])[CH3:43])[O:44][C:45](=[O:46])[CH3:47])(=[O:48])[CH3:49].[CH3:56][CH2:57][O:58][C:59](=[O:60])[CH3:61].[CH3:62][C:63](=[O:64])[OH:65].[CH:16]1([O:19][c:20]2[c:21]([CH:22]=[O:23])[cH:24][c:25](-[n:28]3[n:29][n:30][n:31][c:32]3[C:33]([F:34])([F:35])[F:36])[cH:26][cH:27]2)[CH2:17][CH2:18]1.[Cl:52][CH2:53][CH2:54][Cl:55].[ClH:51].[NH2:1][CH:2]1[C:3]2([c:10]3[cH:11][cH:12][cH:13][cH:14][cH:15]3)[CH2:4][CH2:5][CH:6]([CH2:7][CH2:8]1)[NH:9]2.[Na+:50]>>[NH:1]([CH:2]1[C:3]2([c:10]3[cH:11][cH:12][cH:13][cH:14][cH:15]3)[CH2:4][CH2:5][CH:6]([CH2:7][CH2:8]1)[NH:9]2)[CH2:22][c:21]1[c:20]([O:19][CH:16]2[CH2:17][CH2:18]2)[cH:27][cH:26][c:25](-[n:28]2[n:29][n:30][n:31][c:32]2[C:33]([F:34])([F:35])[F:36])[cH:24]1

Participants

9

Reactant 8

HCID 111,2-DichloroethaneHCID 176Acetic AcidHCID 313Hydrochloric AcidHCID 923Sodium ionHCID 8857Ethyl AcetateHCID 2724942TriacetoxyborohydrideHCID 10902590HCID 10902590, compoundHCID 21931704HCID 21931704, compound

Product 1

HCID 18542514HCID 18542514, compound

Sources & evidence

ORD record
ord-0cb2b242b8284a1cb567757924d3b046
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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