Tetrahydrofuran → HCID 178423546, compound

HRID 190306Notes

Reaction equation

HRID 190306 reaction equation
[CH2:71]1[O:72][CH2:73][CH2:74][CH2:75]1.[CH3:32][C:33]1([CH3:44])[O:34][CH2:35][C:36]([N+:39](=[O:40])[O-:41])([CH2:42][OH:43])[CH2:37][O:38]1.[CH3:45][c:46]1[c:47]([OH:70])[c:48]([CH3:69])[cH:49][c:50](-[c:52]2[n:53][o:54][c:55](-[c:57]3[c:58]4[c:62]([c:63]([CH3:65])[s:64]3)[CH:61]3[CH:60]([CH2:59]4)[C:66]3([CH3:67])[CH3:68])[n:56]2)[cH:51]1.[O:20]=[C:21]([O:22][CH2:23][CH3:24])[N:25]=[N:26][C:27]([O:28][CH2:29][CH3:30])=[O:31].[c:1]1([P:2]([c:3]2[cH:4][cH:5][cH:6][cH:7][cH:8]2)[c:9]2[cH:10][cH:11][cH:12][cH:13][cH:14]2)[cH:15][cH:16][cH:17][cH:18][cH:19]1>>[CH3:32][C:33]1([CH3:44])[O:34][CH2:35][C:36]([N+:39](=[O:40])[O-:41])([CH2:42][O:43][c:47]2[c:46]([CH3:45])[cH:51][c:50](-[c:52]3[n:53][o:54][c:55](-[c:57]4[c:58]5[c:62]([c:63]([CH3:65])[s:64]4)[CH:61]4[CH:60]([CH2:59]5)[C:66]4([CH3:67])[CH3:68])[n:56]3)[cH:49][c:48]2[CH3:69])[CH2:37][O:38]1

Participants

6

Reactant 5

HCID 8028TetrahydrofuranHCID 11776TriphenylphosphineHCID 220568ethyl N-ethoxycarbonyliminocarbamateHCID 300859(2,2-Dimethyl-5-nitro-1,3-dioxan-5-yl)methanolHCID 178423544HCID 178423544, compound

Product 1

HCID 178423546HCID 178423546, compound

Sources & evidence

ORD record
ord-a37a2f3123b443c19e5a5df48dacbac4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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