Ethanol → HCID 58110140, compound

HRID 175479Notes

Reaction equation

HRID 175479 reaction equation
[C:46]([BH3-:47])#[N:48].[CH2:41]1[CH2:42][CH2:43][NH:44][CH2:45]1.[CH3:57][CH2:58][OH:59].[Cl:8][c:9]1[n:10][cH:11][n:12](-[c:14]2[c:15]([O:39][CH3:40])[cH:16][c:17]([NH:20][c:21]3[n:22][n:23]4[c:24]([n:38]3)[CH:25]([c:31]3[cH:32][cH:33][c:34]([F:37])[cH:35][cH:36]3)[CH2:26][C:27](=[O:30])[CH2:28][CH2:29]4)[cH:18][cH:19]2)[cH:13]1.[F:1][C:2]([F:3])([F:4])[C:5]([OH:6])=[O:7].[F:50][C:51]([F:52])([F:53])[C:54]([OH:55])=[O:56].[Na+:49]>>[Cl:8][c:9]1[n:10][cH:11][n:12](-[c:14]2[c:15]([O:39][CH3:40])[cH:16][c:17]([NH:20][c:21]3[n:22][n:23]4[c:24]([n:38]3)[CH:25]([c:31]3[cH:32][cH:33][c:34]([F:37])[cH:35][cH:36]3)[CH2:26][CH:27]([N:44]3[CH2:43][CH2:42][CH2:41][CH2:45]3)[CH2:28][CH2:29]4)[cH:18][cH:19]2)[cH:13]1

Participants

7

Reactant 6

HCID 702EthanolHCID 923Sodium ionHCID 6422Trifluoroacetic acid2×HCID 31268PyrrolidineHCID 498716Cyano-borohydrideHCID 58110014HCID 58110014, compound

Product 1

HCID 58110140HCID 58110140, compound

Sources & evidence

ORD record
ord-9812c861186347bb88e09a447e90d37c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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