Bicarbonate Ion → Pyrrolidin-3-yl Benzoate

HRID 1541081Notes

Reaction equation

HRID 1541081 reaction equation
[C:20]([Cl:21])(=[O:22])[c:23]1[cH:24][cH:25][cH:26][cH:27][cH:28]1.[CH2:1]([N:2]1[CH2:3][CH2:4][CH:5]([OH:6])[CH2:7]1)[c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1.[CH2:34]([c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1)[N:41]1[CH2:42][CH:43]([O:46][C:47]([c:48]2[cH:49][cH:50][cH:51][cH:52][cH:53]2)=[O:54])[CH2:44][CH2:45]1.[CH3:65][OH:66].[Cl:55][C:56]([O:57][CH:58]([Cl:59])[CH3:60])=[O:61].[Cl:62][CH2:63][Cl:64].[Na+:33].[O-:29][C:30]([OH:31])=[O:32].[cH:14]1[cH:15][cH:16][n:17][cH:18][cH:19]1>>[NH:41]1[CH2:42][CH:43]([O:46][C:47]([c:48]2[cH:49][cH:50][cH:51][cH:52][cH:53]2)=[O:54])[CH2:44][CH2:45]1

Participants

10

Reactant 9

HCID 769Bicarbonate IonHCID 887MethanolHCID 923Sodium ionHCID 1049PyridineHCID 6344DichloromethaneHCID 7412Benzoyl chlorideHCID 69889N-benzyl-3-pyrrolidinolHCID 223922N-benzyl-3-benzoyloxypyrrolidineHCID 5213051-Chloroethyl chloroformate

Product 1

HCID 9799108Pyrrolidin-3-yl Benzoate

Sources & evidence

ORD record
ord-70f5d17105174dfe980a668a38678889
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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