Acetic Acid → HCID 66742595, compound

HRID 1202094Notes

Reaction equation

HRID 1202094 reaction equation
[C:23]([O:24][BH-:25]([O:26][C:27](=[O:28])[CH3:29])[O:30][C:31](=[O:32])[CH3:33])(=[O:34])[CH3:35].[C:45](=[O:46])([OH:47])[O-:48].[CH2:41]1[CH2:42][NH:43][CH2:44]1.[CH3:37][C:38](=[O:39])[OH:40].[Cl:1][c:2]1[cH:3][c:4]([NH:10][c:11]2[cH:12][cH:13][c:14]([O:17][C:18]([CH:19]=[O:20])([CH3:21])[CH3:22])[cH:15][n:16]2)[c:5](=[O:9])[n:6]([CH3:8])[n:7]1.[Cl:50][CH2:51][Cl:52].[Na+:36].[Na+:49]>>[Cl:1][c:2]1[cH:3][c:4]([NH:10][c:11]2[cH:12][cH:13][c:14]([O:17][C:18]([CH2:19][N:43]3[CH2:42][CH2:41][CH2:44]3)([CH3:21])[CH3:22])[cH:15][n:16]2)[c:5](=[O:9])[n:6]([CH3:8])[n:7]1

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 769Bicarbonate IonHCID 923Sodium ion2×HCID 6344DichloromethaneHCID 10422AzetidineHCID 2724942TriacetoxyborohydrideHCID 86662317HCID 86662317, compound

Product 1

HCID 66742595HCID 66742595, compound

Sources & evidence

ORD record
ord-13d85ed1b4be4b63b20ea7b7b75af8a5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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