Acetic Acid → HCID 178455087, compound

HRID 120629Notes

Reaction equation

HRID 120629 reaction equation
[C:5]([BH3-:6])#[N:7].[C:9]([CH3:10])([CH3:11])([CH3:12])[Si:13]([O:14][CH:15]1[CH2:16][CH:17]([n:56]2[c:57](=[O:58])[nH:59][c:60](=[O:61])[c:62]([CH3:63])[cH:64]2)[O:18][C:19]1([CH2:20][O:21][Si:22]([c:23]1[cH:24][cH:25][cH:26][cH:27][cH:28]1)([c:29]1[cH:30][cH:31][cH:32][cH:33][cH:34]1)[C:35]([CH3:36])([CH3:37])[CH3:38])[CH:39]([NH:40][CH2:41][c:42]1[cH:43][cH:44][cH:45][cH:46][cH:47]1)[NH:48][CH2:49][c:50]1[cH:51][cH:52][cH:53][cH:54][cH:55]1)([CH3:65])[CH3:66].[CH3:1][C:2](=[O:3])[OH:4].[CH3:67][C:68]#[N:69].[Na+:8]>>[C:9]([CH3:10])([CH3:11])([CH3:12])[Si:13]([O:14][CH:15]1[CH2:16][CH:17]([n:56]2[c:57](=[O:58])[nH:59][c:60](=[O:61])[cH:62][cH:64]2)[O:18][C:19]1([CH2:20][O:21][Si:22]([c:23]1[cH:24][cH:25][cH:26][cH:27][cH:28]1)([c:29]1[cH:30][cH:31][cH:32][cH:33][cH:34]1)[C:35]([CH3:36])([CH3:37])[CH3:38])[CH:39]([NH:40][CH2:41][c:42]1[cH:43][cH:44][cH:45][cH:46][cH:47]1)[NH:48][CH2:49][c:50]1[cH:51][cH:52][cH:53][cH:54][cH:55]1)([CH3:65])[CH3:66]

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 923Sodium ionHCID 6342AcetonitrileHCID 498716Cyano-borohydrideHCID 178430009HCID 178430009, compound

Product 1

HCID 178455087HCID 178455087, compound

Sources & evidence

ORD record
ord-9ae3989559eb4540ab6379aa6027b3ef
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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