Hydrochloric Acid → Tert-butyl 3-[[(1-methoxy-1-oxopropan-2-yl)-phenylmethoxycarbonylamino]methyl]-5-prop-2-enylmorpholine-4-carboxylate

HRID 109378Notes

Reaction equation

HRID 109378 reaction equation
[C:15]([CH3:16])([CH3:17])([CH3:18])[O:19][C:20](=[O:21])[N:22]1[CH:23]([CH2:30][CH:31]=[CH2:32])[CH2:24][O:25][CH2:26][CH:27]1[CH:28]=[O:29].[C:1]([O:2][BH-:3]([O:4][C:5](=[O:6])[CH3:7])[O:8][C:9](=[O:10])[CH3:11])(=[O:12])[CH3:13].[CH3:34][O:35][C:36]([CH:37]([NH2:38])[CH3:39])=[O:40].[Cl:46][C:47](=[O:48])[O:49][CH2:50][c:51]1[cH:52][cH:53][cH:54][cH:55][cH:56]1.[Cl:57][CH2:58][Cl:59].[ClH:33].[Na+:14].[Na+:41].[OH2:60].[OH:42][C:43](=[O:44])[O-:45]>>[C:15]([CH3:16])([CH3:17])([CH3:18])[O:19][C:20](=[O:21])[N:22]1[CH:23]([CH2:30][CH:31]=[CH2:32])[CH2:24][O:25][CH2:26][CH:27]1[CH2:28][N:38]([CH:37]([C:36]([O:35][CH3:34])=[O:40])[CH3:39])[C:47](=[O:48])[O:49][CH2:50][c:51]1[cH:52][cH:53][cH:54][cH:55][cH:56]1

Participants

10

Reactant 9

HCID 313Hydrochloric AcidHCID 769Bicarbonate IonHCID 923Sodium ion2×HCID 962WaterHCID 6344DichloromethaneHCID 10387Benzyl chloroformateHCID 111314DL-Alanine methyl esterHCID 2724942TriacetoxyborohydrideHCID 123727344Tert-butyl 3-formyl-5-prop-2-enylmorpholine-4-carboxylate

Product 1

HCID 77224809Tert-butyl 3-[[(1-methoxy-1-oxopropan-2-yl)-phenylmethoxycarbonylamino]methyl]-5-prop-2-enylmorpholine-4-carboxylate

Sources & evidence

ORD record
ord-67f3ac42fc49419882fa4d92917d7f90
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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