Acetic Acid → HCID 22903495, compound

HRID 2125752Notes

Reaction equation

HRID 2125752 reaction equation
[C:34]([BH3-:35])#[N:36].[C:38](=[O:39])([O-:40])[O-:41].[CH2:32]=[O:33].[CH3:44][OH:45].[CH3:46][C:47](=[O:48])[OH:49].[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:31]1)[CH:7]([NH:29][CH3:30])[CH2:8][CH2:9][CH2:10][N:11]2[C:12]([c:13]1[cH:14][cH:15][c:16]([NH:18][C:19]([c:20]2[c:21]([CH3:26])[cH:22][cH:23][cH:24][cH:25]2)=[O:27])[s:17]1)=[O:28].[K+:42].[K+:43].[Na+:37]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:31]1)[CH:7]([N:29]([CH3:30])[CH3:34])[CH2:8][CH2:9][CH2:10][N:11]2[C:12]([c:13]1[cH:14][cH:15][c:16]([NH:18][C:19]([c:20]2[c:21]([CH3:26])[cH:22][cH:23][cH:24][cH:25]2)=[O:27])[s:17]1)=[O:28]

Participants

9

Reactant 8

HCID 176Acetic AcidHCID 712FormaldehydeHCID 813Potassium Cation2×HCID 887MethanolHCID 923Sodium ionHCID 19660Carbonate IonHCID 498716Cyano-borohydrideHCID 22903503HCID 22903503, compound

Product 1

HCID 22903495HCID 22903495, compound

Sources & evidence

ORD record
ord-3fc1c521358f4d4bbb906d88e7a95a6d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

Loading…