Acetic Acid → HCID 66878604, compound

HRID 301455Notes

Reaction equation

HRID 301455 reaction equation
[C:24]([O:25][BH-:26]([O:27][C:28](=[O:29])[CH3:30])[O:31][C:32](=[O:33])[CH3:34])(=[O:35])[CH3:36].[CH3:20][C:21](=[O:22])[OH:23].[CH:1]1([C:6]2=[C:7]([c:12]3[cH:13][c:14]([CH:18]=[O:19])[cH:15][cH:16][cH:17]3)[C:8](=[O:11])[CH2:9][CH2:10]2)[CH2:2][CH2:3][CH2:4][CH2:5]1.[Cl-:38].[NH4+:39].[Na+:37].[cH:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1>>[CH:1]1([C:6]2=[C:7]([c:12]3[cH:13][c:14]([CH2:18][OH:19])[cH:15][cH:16][cH:17]3)[C:8](=[O:11])[CH2:9][CH2:10]2)[CH2:2][CH2:3][CH2:4][CH2:5]1

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 223AmmoniumHCID 241BenzeneHCID 312ChlorideHCID 923Sodium ionHCID 2724942TriacetoxyborohydrideHCID 86627023HCID 86627023, compound

Product 1

HCID 66878604HCID 66878604, compound

Sources & evidence

ORD record
ord-2bf58090dd3b4ca49b31150685bb5706
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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