Hydrochloric Acid → HCID 12811139, compound

HRID 172735Notes

Reaction equation

HRID 172735 reaction equation
[C:21](=[O:22])([O-:23])[OH:24].[CH2:26]([c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1)[O:33][C:34](=[O:35])[Cl:36].[CH3:2][c:3]1[cH:4][c:5]([C:16](=[O:17])[O:18][CH2:19][CH3:20])[n:6][c:7](-[c:9]2[cH:10][cH:11][c:12]([NH2:15])[cH:13][cH:14]2)[cH:8]1.[CH3:38][CH2:39][O:40][C:41](=[O:42])[CH3:43].[ClH:1].[ClH:37].[Na+:25].[OH2:44]>>[CH3:2][c:3]1[cH:4][c:5]([C:16](=[O:17])[O:18][CH2:19][CH3:20])[n:6][c:7](-[c:9]2[cH:10][cH:11][c:12]([NH:15][C:34]([O:33][CH2:26][c:27]3[cH:28][cH:29][cH:30][cH:31][cH:32]3)=[O:35])[cH:13][cH:14]2)[cH:8]1

Participants

8

Reactant 7

HCID 313Hydrochloric Acid2×HCID 769Bicarbonate IonHCID 923Sodium ionHCID 962WaterHCID 8857Ethyl AcetateHCID 10387Benzyl chloroformateHCID 12811133HCID 12811133, compound

Product 1

HCID 12811139HCID 12811139, compound

Sources & evidence

ORD record
ord-78759a7bcbf948c080f6d01d8c1cb39d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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