Ethanol → dibutyl 3-(N-benzyloxy-N-ethoxycarbonylamino)propylphosphonate

HRID 1147867

Reaction equation

HRID 1147867 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][NH:9][C:10]([O:11][CH2:12][CH3:13])=[O:14].[CH3:16][CH2:17][O-:18].[CH3:35][CH2:36][O:37][C:38](=[O:39])[CH3:40].[CH3:41][CH2:42][OH:43].[Cl:19][CH2:20][CH2:21][CH2:22][P:23]([O:24][CH2:25][CH2:26][CH2:27][CH3:28])([O:29][CH2:30][CH2:31][CH2:32][CH3:33])=[O:34].[Na+:15].[OH2:44]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][N:9]([C:10]([O:11][CH2:12][CH3:13])=[O:14])[CH2:20][CH2:21][CH2:22][P:23]([O:24][CH2:25][CH2:26][CH2:27][CH3:28])([O:29][CH2:30][CH2:31][CH2:32][CH3:33])=[O:34]

Participants

8

Reactant 7

HCID 702EthanolHCID 923Sodium ionHCID 962WaterHCID 8857Ethyl AcetateHCID 1194401-Hydroxyethyl radicalHCID 255288ethyl N-phenylmethoxycarbamateHCID 20337237Dibutyl 3-chloropropylphosphonate

Product 1

HCID 20337230dibutyl 3-(N-benzyloxy-N-ethoxycarbonylamino)propylphosphonate

Sources & evidence

ORD record
ord-899be6e8208d416d87f40fe27b85eb46
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Linked notes

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