Water → Tert-butyl 4-(1-aminocyclopropyl)benzoate

HRID 2150694Notes

Reaction equation

HRID 2150694 reaction equation
[C:8](#[N:9])[c:10]1[cH:11][cH:12][c:13]([C:14](=[O:15])[O:16][C:17]([CH3:18])([CH3:19])[CH3:20])[cH:21][cH:22]1.[CH2:28]1[O:29][CH2:30][CH2:31][CH2:32]1.[CH3:1][CH:2]([CH3:3])[O-:4].[CH3:23][CH2:24][Zn:25][CH2:26][CH3:27].[CH3:33][CH2:34][CH2:35][CH2:36][CH2:37][CH3:38].[CH3:39][CH:40]([CH3:41])[O-:42].[CH3:43][Ti+3:44].[CH3:45][CH:46]([CH3:47])[O-:48].[CH3:49][CH:50]([CH3:51])[O-:52].[I-:6].[Li+:5].[Li+:7].[OH2:53]>>[CH2:1]1[CH2:2][C:8]1([NH2:9])[c:10]1[cH:11][cH:12][c:13]([C:14](=[O:15])[O:16][C:17]([CH3:18])([CH3:19])[CH3:20])[cH:21][cH:22]1

Participants

10

Reactant 9

HCID 962WaterHCID 8028TetrahydrofuranHCID 8058HexaneHCID 28486Lithium ion2×HCID 30165Iodide IonHCID 271408Tert-butyl 4-cyanobenzoateHCID 3260420Isopropanolate4×HCID 178418750HCID 178418750, compoundHCID 178477789HCID 178477789, compound

Product 1

HCID 59305811Tert-butyl 4-(1-aminocyclopropyl)benzoate

Sources & evidence

ORD record
ord-7e025927ef404eb8961d0a51673e7374
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

Loading…