Benzene → HCID 178440542, compound

HRID 692462Notes

Reaction equation

HRID 692462 reaction equation
[CH2:1]([CH2:2][CH2:3][CH3:4])[C:5]12[CH:6]([OH:23])[CH2:7][CH2:8][CH:9]1[CH:10]1[CH:11]([CH2:12][CH2:13]2)[CH:14]2[CH2:15][CH2:16][C:17](=[O:22])[CH:18]=[C:19]2[CH2:20][CH2:21]1.[OH2:35].[c:24]1([CH2:30][CH2:31][C:32](=[O:33])[Cl:34])[cH:25][cH:26][cH:27][cH:28][cH:29]1.[cH:36]1[cH:37][cH:38][n:39][cH:40][cH:41]1.[cH:42]1[cH:43][cH:44][cH:45][cH:46][cH:47]1>>[CH2:1]([CH2:2][CH2:3][CH3:4])[C:5]12[CH:6]([O:23][C:32]([CH2:31][CH2:30][c:24]3[cH:25][cH:26][cH:27][cH:28][cH:29]3)=[O:33])[CH2:7][CH2:8][CH:9]1[CH:10]1[CH:11]([CH2:12][CH2:13]2)[CH:14]2[CH2:15][CH2:16][C:17](=[O:22])[CH:18]=[C:19]2[CH2:20][CH2:21]1

Participants

6

Reactant 5

HCID 241BenzeneHCID 962WaterHCID 1049PyridineHCID 64801Benzenepropanoyl chlorideHCID 178440540HCID 178440540, compound

Product 1

HCID 178440542HCID 178440542, compound

Sources & evidence

ORD record
ord-cb46a038744544959e7d889bfd15851f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

Loading…