Hydrochloric Acid → HCID 21939845, compound

Reaction equation

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

Participants

Reactant 6

HCID 313Hydrochloric Acid

HCID 769Bicarbonate Ion

HCID 923Sodium Ion

HCID 8857Ethyl Acetate

HCID 10387Benzyl chloroformate

HCID 141831Benzeneethanol, 4-amino-, acetate (ester)

Product 1

HCID 21939845HCID 21939845, compound

Sources & evidence

ORD record: ord-ff97796fb4974d818f3a25dc537b9cad
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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