Acetate → HCID 12940761, compound

HRID 691192

Reaction equation

HRID 691192 reaction equation
[CH3:24][CH2:25][CH2:26][CH2:27][CH2:28][CH3:29].[CH3:2][C:3]([O-:4])=[O:5].[CH3:30][C:31](=[O:32])[OH:33].[CH3:6][c:7]1[c:8]([CH2:9][Cl:10])[cH:11][c:12]([N+:15](=[O:16])[O-:17])[cH:13][cH:14]1.[Na+:1].[cH:18]1[cH:19][cH:20][cH:21][cH:22][cH:23]1>>[CH3:2][C:3]([O:4][CH2:9][c:8]1[c:7]([CH3:6])[cH:14][cH:13][c:12]([N+:15](=[O:16])[O-:17])[cH:11]1)=[O:5]

Participants

7

Reactant 6

HCID 175AcetateHCID 176Acetic AcidHCID 241BenzeneHCID 923Sodium ionHCID 8058HexaneHCID 1879522-(Chloromethyl)-1-methyl-4-nitrobenzene

Product 1

HCID 12940761HCID 12940761, compound

Sources & evidence

ORD record
ord-9b17c12d0fa34a7a8b09a59ae1a4530f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Linked notes

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