Carbamic Acid → HCID 20772336, compound

HRID 1564159Notes

Reaction equation

HRID 1564159 reaction equation
[C:43](=[O:44])([OH:45])[NH2:46].[CH2:47]([Cl:48])[Cl:49].[CH3:25][O:26][C:27]([NH:28][CH:29]1[CH:30]([O:38][C:39]([CH3:40])=[O:41])[c:31]2[cH:32][cH:33][cH:34][cH:35][c:36]2[CH2:37]1)=[O:42].[CH3:50][CH2:51][O:52][C:53](=[O:54])[CH3:55].[F:12][C:13]([F:14])([F:15])[C:16]([O:17][C:18](=[O:19])[C:20]([F:21])([F:22])[F:23])=[O:24].[OH2:56].[OH:1][N+:2]([O-:3])=[O:4].[OH:5][C:6]([C:7]([F:8])([F:9])[F:10])=[O:11]>>[O-:1][N+:2](=[O:4])[c:33]1[cH:32][c:31]2[c:36]([cH:35][cH:34]1)[CH2:37][CH:29]([NH:28][C:27]([O:26][CH3:25])=[O:42])[CH:30]2[O:38][C:39]([CH3:40])=[O:41]

Participants

9

Reactant 8

HCID 277Carbamic AcidHCID 944Nitric AcidHCID 962WaterHCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 8857Ethyl AcetateHCID 9845Trifluoroacetic anhydrideHCID 20772337HCID 20772337, compound

Product 1

HCID 20772336HCID 20772336, compound

Sources & evidence

ORD record
ord-91c6627f81094464b98390b5355ad892
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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