Benzene → Chloride

HRID 1118053Notes

Reaction equation

HRID 1118053 reaction equation
[C:1]1([c:7]2[cH:8][cH:9][c:10]([CH:13]([C:14](=[O:15])[OH:16])[CH3:17])[cH:11][cH:12]2)=[CH:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[S:18]([Cl:19])([Cl:20])=[O:21].[cH:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1>>[C:1]1([c:7]2[cH:8][cH:9][c:10]([CH:13]([C:14](=[O:15])[OH:16])[CH3:17])[cH:11][cH:12]2)=[CH:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[Cl-:20]

Participants

5

Reactant 3

HCID 241BenzeneHCID 24386Thionyl ChlorideHCID 1633122-(2',3',4',5'-Tetrahydro[1,1'-biphenyl]-4-yl)propanoic acid

Product 2

HCID 312ChlorideHCID 1633122-(2',3',4',5'-Tetrahydro[1,1'-biphenyl]-4-yl)propanoic acid

Sources & evidence

ORD record
ord-e21d5d2f5600404a98034e6d802fcc23
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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