Hexane → HCID 10824241, compound

HRID 155473Notes

Reaction equation

HRID 155473 reaction equation
[CH3:17][CH2:18][CH2:19][CH2:20][CH2:21][CH3:22].[OH:1][c:2]1[c:3]2[c:4]([n:5][cH:6][c:7]1[C:8]#[N:9])[c:10]1[c:11]([s:12]2)[cH:13][cH:14][cH:15][cH:16]1.[P:23]([Cl:24])([Cl:25])([Cl:26])=[O:27]>>[c:2]1([Cl:25])[c:3]2[c:4]([n:5][cH:6][c:7]1[C:8]#[N:9])[c:10]1[c:11]([s:12]2)[cH:13][cH:14][cH:15][cH:16]1

Participants

4

Reactant 3

HCID 8058HexaneHCID 24813Phosphorus oxychlorideHCID 178510325HCID 178510325, compound

Product 1

HCID 10824241HCID 10824241, compound

Sources & evidence

ORD record
ord-862b2cae2caf46a79a4469de6a8e4a8d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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