Ammonium → 7-Cyclopropylheptanoic acid

HRID 2330509Notes

Reaction equation

HRID 2330509 reaction equation
[Br-:2].[CH2:37]1[O:38][CH2:39][CH2:40][CH2:41]1.[CH:21]1([CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][C:30](=[O:31])[O:32][CH2:33][CH3:34])[CH2:22][CH2:23]1.[CH:3]1([Mg+:4])[CH2:5][CH2:6]1.[Cl-:19].[Cu:42]([I:43])[I:44].[I-:1].[I:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][C:14]([O:15][CH2:16][CH3:17])=[O:18].[NH4+:20].[Na+:36].[OH-:35].[OH2:45]>>[CH:21]1([CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][C:30](=[O:31])[OH:32])[CH2:22][CH2:23]1

Participants

13

Reactant 12

HCID 223AmmoniumHCID 259Bromide ionHCID 312ChlorideHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 8028TetrahydrofuranHCID 30165Iodide IonHCID 83717Copper iodideHCID 10660673Ethyl 7-iodoheptanoateHCID 69049195Ethyl 7-cyclopropylheptanoateHCID 178507030HCID 178507030, compound

Product 1

HCID 161141377-Cyclopropylheptanoic acid

Sources & evidence

ORD record
ord-f694a1fb2a19441db26d6641e2006749
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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