Hexachloroethane → 5-Chloro-4-nitro-1-(oxetan-3-ylmethyl)-1H-pyrazole
Reaction equation
[CH2:32]1[O:33][CH2:34][CH2:35][CH2:36]1.[CH3:15][Si:16]([N-:17][Si:18]([CH3:19])([CH3:20])[CH3:21])([CH3:22])[CH3:23].[Cl:24][C:25]([C:26]([Cl:27])([Cl:28])[Cl:29])([Cl:30])[Cl:31].[Li+:14].[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][n:6][n:7]([CH2:9][CH:10]2[CH2:11][O:12][CH2:13]2)[cH:8]1>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][n:6][n:7]([CH2:9][CH:10]2[CH2:11][O:12][CH2:13]2)[c:8]1[Cl:24]Participants
6
Sources & evidence
- ORD record
- ord-10c09b7234e04282af9ec2454fbd2650
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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