Water → HCID 67099747, compound

HRID 1541195Notes

Reaction equation

HRID 1541195 reaction equation
[F:20][C:21]([c:22]1[cH:23][c:24]([C:28]2([C:34](=[O:35])[CH:36]([C:37](=[O:38])[O:39][CH2:40][CH3:41])[C:42](=[O:43])[O:44][CH2:45][CH3:46])[CH2:29][CH2:30][O:31][CH2:32][CH2:33]2)[cH:25][cH:26][cH:27]1)([F:47])[F:48].[O:6]=[P:7]12[O:8][P:9]3(=[O:19])[O:10][P:11](=[O:17])([O:12][P:13](=[O:16])([O:14]3)[O:15]1)[O:18]2.[OH2:49].[S:1](=[O:2])(=[O:3])([OH:4])[OH:5]>>[F:20][C:21]([c:22]1[cH:23][c:24]2[c:25]([cH:26][cH:27]1)[C:37]([OH:38])=[C:36]([C:42](=[O:43])[O:44][CH2:45][CH3:46])[C:34](=[O:35])[C:28]21[CH2:29][CH2:30][O:31][CH2:32][CH2:33]1)([F:47])[F:48]

Participants

5

Reactant 4

HCID 962WaterHCID 1118Sulfuric AcidHCID 14812Phosphorus oxide (P4O10)HCID 67099793diethyl 2-(4-(3-(trifluoromethyl)phenyl)-tetrahydro-2H-pyran-4-carbonyl)malonate

Product 1

HCID 67099747HCID 67099747, compound

Sources & evidence

ORD record
ord-395cc9731cb44a31b23aeb6fffc2c055
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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