Acetic Acid → HCID 57849499, compound

HRID 88756Notes

Reaction equation

HRID 88756 reaction equation
[C:30]([O:31][BH-:32]([O:33][C:40](=[O:34])[CH3:41])[O:35][C:36](=[O:37])[CH3:38])(=[O:39])[CH3:42].[CH3:44][C:45](=[O:46])[OH:47].[CH3:52][C:53](=[O:54])[CH3:55].[Cl:48][CH:49]([Cl:50])[CH3:51].[Cl:56][CH2:57][Cl:58].[Na+:43].[c:1]1([CH:7]2[CH2:8][N:9]([CH2:13][c:14]3[cH:15][cH:16][c:17](-[c:20]4[c:21]([C:26]([F:27])([F:28])[F:29])[cH:22][cH:23][cH:24][cH:25]4)[cH:18][cH:19]3)[CH2:10][CH2:11][NH:12]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH:7]2[CH2:8][N:9]([CH2:13][c:14]3[cH:15][cH:16][c:17](-[c:20]4[c:21]([C:26]([F:27])([F:28])[F:29])[cH:22][cH:23][cH:24][cH:25]4)[cH:18][cH:19]3)[CH2:10][CH2:11][N:12]2[CH:40]([CH3:41])[CH3:44])[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 180AcetoneHCID 923Sodium ionHCID 6344DichloromethaneHCID 63651,1-DichloroethaneHCID 2724942TriacetoxyborohydrideHCID 57849459HCID 57849459, compound

Product 1

HCID 57849499HCID 57849499, compound

Sources & evidence

ORD record
ord-4c71332165b34a81bc257cd2dbef5430
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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