Acetonitrile → HCID 53643762, compound

HRID 1207490Notes

Reaction equation

HRID 1207490 reaction equation
[CH3:31][CH2:32][CH2:33][CH2:34][CH2:35][CH3:36].[CH3:37][C:38]#[N:39].[CH:15]12[CH2:16][N:17]([C:24](=[O:25])[O:26][C:27]([CH3:28])([CH3:29])[CH3:30])[CH2:18][CH:19]([CH2:20][NH:21][CH2:22]1)[CH2:23]2.[Cl:1][CH2:2][CH2:3][CH2:4][O:5][c:6]1[c:7]([OH:14])[cH:8][c:9]([C:10]#[N:11])[cH:12][cH:13]1>>[CH2:2]([CH2:3][CH2:4][O:5][c:6]1[c:7]([OH:14])[cH:8][c:9]([C:10]#[N:11])[cH:12][cH:13]1)[N:21]1[CH2:20][CH:19]2[CH2:18][N:17]([C:24](=[O:25])[O:26][C:27]([CH3:28])([CH3:29])[CH3:30])[CH2:16][CH:15]([CH2:22]1)[CH2:23]2

Participants

5

Reactant 4

HCID 6342AcetonitrileHCID 8058HexaneHCID 21701922HCID 21701922, compoundHCID 22490264Tert-butyl 3,7-diazabicyclo(3.3.1)nonane-3-carboxylate

Product 1

HCID 53643762HCID 53643762, compound

Sources & evidence

ORD record
ord-ec780b8ba06145b9846cb4f9385a0dbd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

Loading…