Thionyl Chloride → HCID 178428742, compound

HRID 2124167Notes

Reaction equation

HRID 2124167 reaction equation
[CH3:12][c:13]1[c:14]([N:22]=[C:23]=[S:24])[cH:15][cH:16][c:17]([N+:19](=[O:20])[O-:21])[cH:18]1.[CH:1]([CH3:2])([CH3:3])[CH:4]([CH2:5][OH:6])[NH2:7].[S:8]([Cl:9])([Cl:10])=[O:11]>>[CH:1]([CH3:2])([CH3:3])[CH:4]1[CH2:5][S:24][C:23](=[N:22][c:14]2[c:13]([CH3:12])[cH:18][c:17]([N+:19](=[O:20])[O-:21])[cH:16][cH:15]2)[NH:7]1

Participants

4

Reactant 3

HCID 24386Thionyl ChlorideHCID 79019ValinolHCID 1456212-Methyl-4-nitrophenyl isothiocyanate

Product 1

HCID 178428742HCID 178428742, compound

Sources & evidence

ORD record
ord-115dbf9068864c509863200479cbb3cf
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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