Chloride → 4,4-Dimethyl-7-bromo-1-phenylthio-3,4-dihydronaphthalene

HRID 2150271Notes

Reaction equation

HRID 2150271 reaction equation
[Br:22][c:23]1[cH:24][cH:25][c:26]2[c:31]([cH:32]1)[C:30](=[O:33])[CH2:29][CH2:28][C:27]2([CH3:34])[CH3:35].[C:11]1(=[O:12])[C:13]2=[CH:18][CH:17]=[CH:16][CH2:15][CH:14]2[CH2:19][CH2:20][CH2:21]1.[CH2:1]1[c:2]2[c:3]([cH:4][cH:5][cH:6][cH:7]2)[CH:8]=[CH:9][CH2:10]1.[CH3:53][CH2:54][N:55]([CH2:56][CH3:57])[CH2:58][CH3:59].[Cl-:48].[Cl-:49].[Cl-:50].[Cl-:51].[O:43]1[CH2:44][CH2:45][CH2:46][CH2:47]1.[SH:36][c:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1.[Ti+4:52]>>[Br:22][c:23]1[cH:24][cH:25][c:26]2[c:31]([cH:32]1)[C:30]([S:36][c:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1)=[CH:29][CH2:28][C:27]2([CH3:34])[CH3:35]

Participants

9

Reactant 8

HCID 312Chloride4×HCID 7969ThiophenolHCID 8028TetrahydrofuranHCID 8471TriethylamineHCID 99381,2-DihydronaphthaleneHCID 114942Titanium cation (4+)HCID 107533577-Bromo-4,4-dimethyl-1,2,3,4-tetrahydronaphthalen-1-oneHCID 14148769Tetrahydronaphthalene-one

Product 1

HCID 158960184,4-Dimethyl-7-bromo-1-phenylthio-3,4-dihydronaphthalene

Sources & evidence

ORD record
ord-23c2840ef5794ff7b3360e6fd742489a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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