Hexane → HCID 21980360, compound

HRID 1557787Notes

Reaction equation

HRID 1557787 reaction equation
[C:41]([O:42][CH2:43][CH3:44])(=[O:45])[CH3:46].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[n:8]1[c:9]2[cH:10][cH:11][c:12]([O:33][CH3:34])[cH:13][c:14]2[c:15]2[c:16]3[c:17]([c:18](-[c:21]4[c:22]([Cl:27])[cH:23][cH:24][cH:25][cH:26]4)[cH:19][c:20]12)[C:28](=[O:32])[NH:29][C:30]3=[O:31].[CH3:35][CH2:36][CH2:37][CH2:38][CH2:39][CH3:40]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[n:8]1[c:9]2[cH:10][cH:11][c:12]([OH:33])[cH:13][c:14]2[c:15]2[c:16]3[c:17]([c:18](-[c:21]4[c:22]([Cl:27])[cH:23][cH:24][cH:25][cH:26]4)[cH:19][c:20]12)[C:28](=[O:32])[NH:29][C:30]3=[O:31]

Participants

4

Reactant 3

HCID 8058HexaneHCID 8857Ethyl AcetateHCID 91353699HCID 91353699, compound

Product 1

HCID 21980360HCID 21980360, compound

Sources & evidence

ORD record
ord-6e0317687a2f475b85cd8d941a409934
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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