Phenyl isocyanate → HCID 10555594, compound

HRID 2315484Notes

Reaction equation

HRID 2315484 reaction equation
[CH2:1]([CH3:2])[N:3]([CH2:4][CH3:5])[CH2:6][c:7]1[c:8]([C:30](=[O:31])[O:32][CH2:33][CH3:34])[c:9](-[c:20]2[cH:21][c:22]([O:28][CH3:29])[c:23]([O:26][CH3:27])[cH:24][cH:25]2)[c:10]2[c:11]([n:12]1)[s:13][c:14]1[c:19]2[CH2:18][CH2:17][NH:16][CH2:15]1.[O:35]=[C:36]=[N:37][c:38]1[cH:39][cH:40][cH:41][cH:42][cH:43]1.[O:44]1[CH2:45][CH2:46][CH2:47][CH2:48]1>>[CH2:1]([CH3:2])[N:3]([CH2:4][CH3:5])[CH2:6][c:7]1[c:8]([C:30](=[O:31])[O:32][CH2:33][CH3:34])[c:9](-[c:20]2[cH:21][c:22]([O:28][CH3:29])[c:23]([O:26][CH3:27])[cH:24][cH:25]2)[c:10]2[c:11]([n:12]1)[s:13][c:14]1[c:19]2[CH2:18][CH2:17][N:16]([C:36](=[O:35])[NH:37][c:38]2[cH:39][cH:40][cH:41][cH:42][cH:43]2)[CH2:15]1

Participants

4

Reactant 3

HCID 7672Phenyl isocyanateHCID 8028TetrahydrofuranHCID 10505011HCID 10505011, compound

Product 1

HCID 10555594HCID 10555594, compound

Sources & evidence

ORD record
ord-8d6d1f33a0944db6bd0b7a4e8c8445f2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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