Benzonitrile, 4-chloro-3-nitro- → HCID 86752536, compound

HRID 160780Notes

Reaction equation

HRID 160780 reaction equation
[CH2:13]([CH3:14])[O:15][P:16]([O:17][CH2:18][CH3:19])(=[O:20])[CH:21]([CH3:22])[NH2:23].[Cl:1][c:2]1[c:3]([N+:10](=[O:11])[O-:12])[cH:4][c:5]([C:6]#[N:7])[cH:8][cH:9]1>>[c:2]1([NH:23][CH:21]([P:16]([O:15][CH2:13][CH3:14])([O:17][CH2:18][CH3:19])=[O:20])[CH3:22])[c:3]([N+:10](=[O:11])[O-:12])[cH:4][c:5]([C:6]#[N:7])[cH:8][cH:9]1

Participants

3

Reactant 2

HCID 13655Benzonitrile, 4-chloro-3-nitro-HCID 5149858Phosphonic acid, (1-aminoethyl)-, diethyl ester

Product 1

HCID 86752536HCID 86752536, compound

Sources & evidence

ORD record
ord-64543c957a774c6db0044a7236c78b1c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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