Water → 4-(5-Octyl pyrimidine-2-yl)phenyl nonafluorobutane sulfonate

HRID 950935Notes

Reaction equation

HRID 950935 reaction equation
[C:39]([O:40][CH3:41])([CH3:42])([CH3:43])[CH3:44].[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH3:8])[c:9]1[cH:10][n:11][c:12](-[c:15]2[cH:16][cH:17][c:18]([OH:21])[cH:19][cH:20]2)[n:13][cH:14]1.[F:22][C:23]([C:24]([C:25]([C:26]([F:27])([F:28])[F:29])([F:30])[F:31])([F:32])[F:33])([S:34](=[O:35])(=[O:36])[F:37])[F:38].[N:45]12[CH2:46][CH2:47][CH2:48][N:49]=[C:50]1[CH2:51][CH2:52][CH2:53][CH2:54][CH2:55]2.[OH2:56]>>[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH3:8])[c:9]1[cH:10][n:11][c:12](-[c:15]2[cH:16][cH:17][c:18]([O:21][S:34]([C:23]([F:22])([C:24]([C:25]([C:26]([F:27])([F:28])[F:29])([F:30])[F:31])([F:32])[F:33])[F:38])(=[O:35])=[O:36])[cH:19][cH:20]2)[n:13][cH:14]1

Participants

6

Reactant 5

HCID 962WaterHCID 15413tert-Butyl methyl etherHCID 67814Perfluoro-1-butanesulfonyl fluorideHCID 811841,8-Diazabicyclo(5.4.0)undec-7-eneHCID 6040552-(4-Hydroxyphenyl)-5-octylpyrimidine

Product 1

HCID 542376574-(5-Octyl pyrimidine-2-yl)phenyl nonafluorobutane sulfonate

Sources & evidence

ORD record
ord-05b76a5668b3444e8c0294d6a9f06e82
Source dataset
Validation data from https://doi.org/10.1039/C8SC04228D

Reaction notes

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