Acetic Acid → HCID 59398349, compound

HRID 306741Notes

Reaction equation

HRID 306741 reaction equation
[C:41]([O:42][BH-:43]([O:44][C:45](=[O:46])[CH3:47])[O:48][C:49](=[O:50])[CH3:51])(=[O:52])[CH3:53].[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]2[c:7]([CH3:27])[cH:8][c:9](=[O:26])[n:10]([CH2:13][CH2:14][N:15]3[CH:16]([C:21](=[O:22])[O:23][CH2:24][CH3:25])[CH2:17][NH:18][CH2:19][CH2:20]3)[c:11]2[cH:12]1.[CH3:61][C:62](=[O:63])[OH:64].[CH:57]([Cl:58])([Cl:59])[Cl:60].[Cl:65][CH2:66][Cl:67].[ClH:55].[Na+:54].[O:28]1[CH2:29][CH2:30][O:31][c:32]2[c:33]1[cH:34][cH:35][c:36]([CH2:38][CH:39]=[O:40])[cH:37]2.[OH2:56]>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]2[c:7]([CH3:27])[cH:8][c:9](=[O:26])[n:10]([CH2:13][CH2:14][N:15]3[CH:16]([C:21](=[O:22])[O:23][CH2:24][CH3:25])[CH2:17][N:18]([CH2:39][CH2:38][c:36]4[cH:35][cH:34][c:33]5[c:32]([cH:37]4)[O:31][CH2:30][CH2:29][O:28]5)[CH2:19][CH2:20]3)[c:11]2[cH:12]1

Participants

10

Reactant 9

HCID 176Acetic AcidHCID 313Hydrochloric AcidHCID 923Sodium ionHCID 962WaterHCID 6212ChloroformHCID 6344DichloromethaneHCID 2724942TriacetoxyborohydrideHCID 17979906HCID 17979906, compoundHCID 59398295HCID 59398295, compound

Product 1

HCID 59398349HCID 59398349, compound

Sources & evidence

ORD record
ord-32eaa4f4a4a145b9a6f31211e2c0122d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

Loading…