Ammonium → 2-(Bis-(2,2,2-trifluoroethoxy)phosphoryl)-6-[6-methoxy-7-methyl-3-oxo-4-(2-trimethylsilanyl-ethoxy)-1,3-dihydro-isobenzofuran-5-yl]-4-methyl-hex-4-enoic Acid Methyl Ester

HRID 319168

Reaction equation

HRID 319168 reaction equation
[Br:20][CH2:21][C:22](=[CH:23][CH2:24][c:25]1[c:26]([O:43][CH3:44])[c:27]([CH3:42])[c:28]2[c:32]([c:33]1[O:34][CH2:35][CH2:36][Si:37]([CH3:38])([CH3:39])[CH3:40])[C:31](=[O:41])[O:30][CH2:29]2)[CH3:45].[CH2:54]1[O:55][CH2:56][CH2:57][CH2:58]1.[CH3:1][O:2][C:3]([CH2:4][P:5](=[O:6])([O:7][CH2:8][C:9]([F:10])([F:11])[F:12])[O:13][CH2:14][C:15]([F:16])([F:17])[F:18])=[O:19].[CH3:48][CH2:49][O:50][C:51]([CH3:52])=[O:53].[Cl-:46].[NH4+:47]>>[CH3:1][O:2][C:3]([CH:4]([P:5](=[O:6])([O:7][CH2:8][C:9]([F:10])([F:11])[F:12])[O:13][CH2:14][C:15]([F:16])([F:17])[F:18])[CH2:21][C:22](=[CH:23][CH2:24][c:25]1[c:26]([O:43][CH3:44])[c:27]([CH3:42])[c:28]2[c:32]([c:33]1[O:34][CH2:35][CH2:36][Si:37]([CH3:38])([CH3:39])[CH3:40])[C:31](=[O:41])[O:30][CH2:29]2)[CH3:45])=[O:19]

Participants

7

Reactant 6

HCID 223AmmoniumHCID 312ChlorideHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 184894Nsc 634137HCID 670106966-(4-bromo-3-methyl-but-2-enyl)-5-methoxy-4-methyl-7-(2-trimethylsilanyl-ethoxy)-3H-isobenzofuran-1-one

Product 1

HCID 866016102-(Bis-(2,2,2-trifluoroethoxy)phosphoryl)-6-[6-methoxy-7-methyl-3-oxo-4-(2-trimethylsilanyl-ethoxy)-1,3-dihydro-isobenzofuran-5-yl]-4-methyl-hex-4-enoic Acid Methyl Ester

Sources & evidence

ORD record
ord-d6acfc40d54f4940b776863e4e497793
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Linked notes

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