Ethyl Acetate → 12-Chloro-6-chrysenecarbaldehyde

HRID 191374

Reaction equation

HRID 191374 reaction equation
[CH3:40][CH2:41][O:42][C:43]([CH3:44])=[O:45].[Cl:1][c:2]1[cH:3][c:4]2[c:5]3[cH:6][cH:7][cH:8][cH:9][c:10]3[cH:11][cH:12][c:13]2[c:14]2[cH:15][cH:16][cH:17][cH:18][c:19]12.[cH:20]1[c:21]2[cH:22][cH:23][c:24]3[c:25]([cH:26][c:27]([CH:38]=[O:39])[c:28]4[c:29]3[cH:30][cH:31][cH:32][cH:33]4)[c:34]2[cH:35][cH:36][cH:37]1>>[Cl:1][c:2]1[cH:3][c:4]2[c:5]3[cH:6][cH:7][cH:8][cH:9][c:10]3[c:11]([CH:38]=[O:39])[cH:12][c:13]2[c:14]2[cH:15][cH:16][cH:17][cH:18][c:19]12

Participants

4

Reactant 3

HCID 8857Ethyl AcetateHCID 56969Chrysene, 6-chloro-HCID 124387746-Chrysenecarbaldehyde

Product 1

HCID 1337538912-Chloro-6-chrysenecarbaldehyde

Sources & evidence

ORD record
ord-f5d51b3aa6da4d908cf2ac43a7d5692a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Linked notes

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