Acetic Acid → 1-Boc-4-AP

HRID 1146899Notes

Reaction equation

HRID 1146899 reaction equation
[C:1](=[O:2])([O:3][C:4]([CH3:5])([CH3:6])[CH3:7])[N:8]1[CH2:9][CH2:10][C:11](=[O:14])[CH2:12][CH2:13]1.[C:26]([O:27][BH-:28]([O:29][C:30](=[O:31])[CH3:32])[O:33][C:34](=[O:35])[CH3:36])(=[O:37])[CH3:38].[CH3:22][C:23](=[O:24])[OH:25].[Cl:40][CH:41]([Cl:42])[CH3:43].[NH2:15][c:16]1[cH:17][cH:18][cH:19][cH:20][cH:21]1.[Na+:39].[OH2:44]>>[C:1](=[O:2])([O:3][C:4]([CH3:5])([CH3:6])[CH3:7])[N:8]1[CH2:9][CH2:10][CH:11]([NH:15][c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[CH2:12][CH2:13]1

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 923Sodium ionHCID 962WaterHCID 6115AnilineHCID 63651,1-DichloroethaneHCID 735900tert-Butyl 4-oxopiperidine-1-carboxylateHCID 2724942Triacetoxyborohydride

Product 1

HCID 14915021-Boc-4-AP

Sources & evidence

ORD record
ord-182e352bbae644e8a6a61e6894dfbf6d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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