Acetic Acid → HCID 67107904, compound

HRID 699337Notes

Reaction equation

HRID 699337 reaction equation
[C:31]([BH3-:32])#[N:33].[CH2:25]1[CH2:26][O:27][CH2:28][CH2:29][NH:30]1.[CH3:40][C:41](=[O:42])[OH:43].[N+:2](=[O:3])([O-:4])[c:5]1[cH:6][cH:7][c:8]([N:11]2[CH2:12][CH2:13][N:14]([c:17]3[cH:18][cH:19][c:20]([CH:21]=[O:22])[cH:23][cH:24]3)[CH2:15][CH2:16]2)[cH:9][cH:10]1.[Na+:34].[O:35]1[CH2:36][CH2:37][CH2:38][CH2:39]1.[OH2:1]>>[N+:2](=[O:3])([O-:4])[c:5]1[cH:6][cH:7][c:8]([N:11]2[CH2:12][CH2:13][N:14]([c:17]3[cH:18][cH:19][c:20]([CH2:21][N:30]4[CH2:25][CH2:26][O:27][CH2:28][CH2:29]4)[cH:23][cH:24]3)[CH2:15][CH2:16]2)[cH:9][cH:10]1

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 923Sodium ionHCID 962WaterHCID 8028TetrahydrofuranHCID 8083MorpholineHCID 498716Cyano-borohydrideHCID 45920966HCID 45920966, compound

Product 1

HCID 67107904HCID 67107904, compound

Sources & evidence

ORD record
ord-204b98b76c20468d82d1937aa79e61d2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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