Acetic Acid → HCID 69158017, compound

HRID 1152677Notes

Reaction equation

HRID 1152677 reaction equation
[C:15]([CH3:16])([CH3:17])([CH3:18])[O:19][C:20](=[O:21])[N:22]1[CH2:23][CH2:24][C:25](=[O:28])[CH2:26][CH2:27]1.[C:29]([O:30][BH-:31]([O:32][C:33](=[O:34])[CH3:35])[O:36][C:37](=[O:38])[CH3:39])(=[O:40])[CH3:41].[CH2:1]([O:2][C:4]([CH2:5][c:6]1[c:7]([NH2:13])[cH:8][cH:9][c:10]([Cl:12])[cH:11]1)=[O:14])[CH3:3].[CH3:51][C:52](=[O:53])[OH:54].[Cl:48][CH2:49][Cl:50].[Na+:42].[Na+:47].[O-:43][C:44]([OH:45])=[O:46]>>[C:4]1(=[O:14])[CH2:5][c:6]2[c:7]([cH:8][cH:9][c:10]([Cl:12])[cH:11]2)[N:13]1[CH:25]1[CH2:24][CH2:23][N:22]([C:20]([O:19][C:15]([CH3:16])([CH3:17])[CH3:18])=[O:21])[CH2:27][CH2:26]1

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 769Bicarbonate IonHCID 923Sodium ion2×HCID 6344DichloromethaneHCID 735900tert-Butyl 4-oxopiperidine-1-carboxylateHCID 2724942TriacetoxyborohydrideHCID 69159126HCID 69159126, compound

Product 1

HCID 69158017HCID 69158017, compound

Sources & evidence

ORD record
ord-c45873c6c0de4c0ea764e0c3e297c2fe
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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