Hydrochloric Acid → 2-(4-Fluoro-benzylamino)-cyclopentanecarboxylic acid methyl ester

HRID 2348489Notes

Reaction equation

HRID 2348489 reaction equation
[BH4-:34].[C:36](=[O:37])([OH:38])[O-:39].[CH3:18][CH2:19][N:20]([CH2:21][CH3:22])[CH2:23][CH3:24].[CH3:2][O:3][C:4](=[O:5])[CH:6]1[CH:7]([NH2:11])[CH2:8][CH2:9][CH2:10]1.[ClH:1].[F:25][c:26]1[cH:27][cH:28][c:29]([CH:30]=[O:31])[cH:32][cH:33]1.[Mg+2:12].[Na+:35].[Na+:40].[O-:13][S:14](=[O:15])(=[O:16])[O-:17].[O:41]1[CH2:42][CH2:43][CH2:44][CH2:45]1>>[CH3:2][O:3][C:4](=[O:5])[CH:6]1[CH:7]([NH:11][CH2:30][c:29]2[cH:28][cH:27][c:26]([F:25])[cH:33][cH:32]2)[CH2:8][CH2:9][CH2:10]1

Participants

11

Reactant 10

HCID 313Hydrochloric AcidHCID 769Bicarbonate IonHCID 888Magnesium CationHCID 923Sodium ion2×HCID 1117Sulfate IonHCID 8028TetrahydrofuranHCID 8471TriethylamineHCID 28123BorohydrideHCID 680234-FluorobenzaldehydeHCID 14698813Methyl 2-aminocyclopentanecarboxylate

Product 1

HCID 576711952-(4-Fluoro-benzylamino)-cyclopentanecarboxylic acid methyl ester

Sources & evidence

ORD record
ord-cc6874b14e2c48e4ad705189a5283fd3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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