Cyclohexanecarboxylic acid → HCID 54176203, compound

HRID 113821Notes

Reaction equation

HRID 113821 reaction equation
[CH3:42][CH2:43][O:44][C:45](=[O:46])[CH3:47].[Cl:1][C:2]([O:3][CH2:4][CH3:5])=[O:6].[N:16]1([CH2:22][c:23]2[cH:24][c:25]([O:29][CH2:30][CH:31]=[CH:32][CH2:33][NH:34][C:35]([CH2:36][S:37][CH2:38][CH2:39][OH:40])=[O:41])[n:26][cH:27][cH:28]2)[CH2:17][CH2:18][CH2:19][CH2:20][CH2:21]1.[OH:7][C:8](=[O:9])[CH:10]1[CH2:11][CH2:12][CH2:13][CH2:14][CH2:15]1>>[O:7]=[C:8]([O:9][CH2:39][CH2:38][S:37][CH2:36][C:35]([NH:34][CH2:33][CH:32]=[CH:31][CH2:30][O:29][c:25]1[cH:24][c:23]([CH2:22][N:16]2[CH2:17][CH2:18][CH2:19][CH2:20][CH2:21]2)[cH:28][cH:27][n:26]1)=[O:41])[CH:10]1[CH2:11][CH2:12][CH2:13][CH2:14][CH2:15]1

Participants

5

Reactant 4

HCID 7413Cyclohexanecarboxylic acidHCID 8857Ethyl AcetateHCID 10928Ethyl chloroformateHCID 53863444HCID 53863444, compound

Product 1

HCID 54176203HCID 54176203, compound

Sources & evidence

ORD record
ord-623afe5cbb1245e3b2b71dd0e848d37f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

Loading…