Acetic Acid → HCID 1070048, compound

HRID 281861Notes

Reaction equation

HRID 281861 reaction equation
[C:1]([O:2][BH-:3]([O:4][C:5](=[O:6])[CH3:7])[O:8][C:9](=[O:10])[CH3:11])(=[O:12])[CH3:13].[CH2:29]([c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1)[N:36]1[CH2:37][CH2:38][C:39](=[O:42])[CH2:40][CH2:41]1.[CH3:15][O:16][c:17]1[c:18]([N:23]2[CH2:24][CH2:25][NH:26][CH2:27][CH2:28]2)[cH:19][cH:20][cH:21][cH:22]1.[CH3:51][C:52](=[O:53])[OH:54].[Cl:48][CH2:49][Cl:50].[Na+:14].[Na+:47].[O-:43][C:44]([OH:45])=[O:46]>>[CH3:15][O:16][c:17]1[c:18]([N:23]2[CH2:24][CH2:25][N:26]([CH:39]3[CH2:38][CH2:37][N:36]([CH2:29][c:30]4[cH:31][cH:32][cH:33][cH:34][cH:35]4)[CH2:41][CH2:40]3)[CH2:27][CH2:28]2)[cH:19][cH:20][cH:21][cH:22]1

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 769Bicarbonate IonHCID 923Sodium ion2×HCID 13461-(2-Methoxyphenyl)piperazineHCID 6344DichloromethaneHCID 192201-Benzyl-4-piperidoneHCID 2724942Triacetoxyborohydride

Product 1

HCID 1070048HCID 1070048, compound

Sources & evidence

ORD record
ord-333cd133cb9b4c17b993ef0302a88edf
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

Loading…