Acetic Acid → HCID 21477003, compound

HRID 1120514Notes

Reaction equation

HRID 1120514 reaction equation
[C:21]([O:22][BH-:23]([O:24][C:25](=[O:26])[CH3:27])[O:28][C:29](=[O:30])[CH3:31])(=[O:32])[CH3:33].[CH3:35][C:36](=[O:37])[OH:38].[NH2:1][c:2]1[cH:3][c:4]([O:12][CH3:13])[c:5]([C:6](=[O:7])[OH:8])[cH:9][c:10]1[Cl:11].[Na+:34].[O:14]=[C:15]1[CH2:16][CH2:17][CH2:18][CH2:19][CH2:20]1>>[NH:1]([c:2]1[cH:3][c:4]([O:12][CH3:13])[c:5]([C:6](=[O:7])[OH:8])[cH:9][c:10]1[Cl:11])[CH:15]1[CH2:16][CH2:17][CH2:18][CH2:19][CH2:20]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 923Sodium ionHCID 7967CyclohexanoneHCID 816264-Amino-5-chloro-2-methoxybenzoic acidHCID 2724942Triacetoxyborohydride

Product 1

HCID 21477003HCID 21477003, compound

Sources & evidence

ORD record
ord-20b7592ff7914655b186bd127eaa5b6f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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