Acetic Acid → HCID 66674037, compound

HRID 299561Notes

Reaction equation

HRID 299561 reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]([N:8]2[CH2:9][CH:10]([OH:15])[CH:11]([NH:13][CH3:14])[CH2:12]2)[n:6][cH:7]1.[C:28]([O:29][BH-:30]([O:31][C:32](=[O:33])[CH3:34])[O:35][C:36](=[O:37])[CH3:38])(=[O:39])[CH3:40].[C:50](=[O:51])([OH:52])[O-:53].[CH3:16][O:17][c:18]1[cH:19][cH:20][c:21]([CH:22]=[O:23])[cH:24][c:25]1[O:26][CH3:27].[CH3:42][C:43](=[O:44])[OH:45].[Cl:46][CH:47]([Cl:48])[CH3:49].[Na+:41].[Na+:54]>>[Br:1][c:2]1[cH:3][cH:4][c:5]([N:8]2[CH2:9][CH:10]([OH:15])[CH:11]([N:13]([CH3:14])[CH2:22][c:21]3[cH:20][cH:19][c:18]([O:17][CH3:16])[c:25]([O:26][CH3:27])[cH:24]3)[CH2:12]2)[n:6][cH:7]1

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 769Bicarbonate IonHCID 923Sodium ion2×HCID 63651,1-DichloroethaneHCID 8419VeratraldehydeHCID 2724942TriacetoxyborohydrideHCID 66673284HCID 66673284, compound

Product 1

HCID 66674037HCID 66674037, compound

Sources & evidence

ORD record
ord-ca536776336140718be0b8466cce7dba
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

Loading…