Chloride → HCID 178457331, compound

HRID 1548763Notes

Reaction equation

HRID 1548763 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[CH:8]1[N:9]([C:14]([CH2:15][c:16]2[s:17][c:18]([Cl:21])[cH:19][cH:20]2)=[O:22])[C:10](=[O:13])[O:11][CH2:12]1.[CH:23]([N:24]([CH2:25][CH3:26])[CH:27]([CH3:28])[CH3:29])([CH3:30])[CH3:31].[CH:32]([CH3:33])([CH3:34])[N:35]([C:36]([O:37][C:38]([CH3:39])([CH3:40])[CH3:41])=[O:42])[CH2:43][O:44][CH3:45].[Cl-:49].[Cl-:50].[Cl-:51].[Cl-:52].[Cl:46][CH2:47][Cl:48].[Ti+4:53]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[CH:8]1[N:9]([C:14]([CH:15]([c:16]2[s:17][c:18]([Cl:21])[cH:19][cH:20]2)[CH2:43][N:35]([CH:32]([CH3:33])[CH3:34])[C:36]([O:37][C:38]([CH3:39])([CH3:40])[CH3:41])=[O:42])=[O:22])[C:10](=[O:13])[O:11][CH2:12]1

Participants

7

Reactant 6

HCID 312Chloride4×HCID 6344DichloromethaneHCID 81531DiisopropylethylamineHCID 114942Titanium cation (4+)HCID 666181244-Benzyl-3-[2-(5-chlorothiophen-2-yl)acetyl]-1,3-oxazolidin-2-oneHCID 86618742tert-butyl N-isopropyl-N-(methoxymethyl)carbamate

Product 1

HCID 178457331HCID 178457331, compound

Sources & evidence

ORD record
ord-f64e550e2cd949d3ae3b5c89cc3c3d99
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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