Phosphoric Acid → Phosphoric Acid

HRID 2342159Notes

Reaction equation

HRID 2342159 reaction equation
[CH:29]([OH:30])([CH3:31])[CH3:32].[P:24]([OH:25])([OH:26])([OH:27])=[O:28].[n:1]1[cH:2][n:3][c:4](-[c:10]2[cH:11][n:12][n:13]([CH:15]([CH2:16][C:17]#[N:18])[CH2:19][CH2:20][CH2:21][CH2:22][CH3:23])[cH:14]2)[c:5]2[c:6]1[nH:7][cH:8][cH:9]2>>[P:24](=[O:25])([OH:26])([OH:27])[OH:28].[n:1]1[cH:2][n:3][c:4](-[c:10]2[cH:11][n:12][n:13]([CH:15]([CH2:16][C:17]#[N:18])[CH2:19][CH2:20][CH2:21][CH2:22][CH3:23])[cH:14]2)[c:5]2[c:6]1[nH:7][cH:8][cH:9]2

Participants

5

Reactant 3

HCID 1004Phosphoric AcidHCID 3776IsopropanolHCID 49779329HCID 49779329, compound

Product 2

HCID 1004Phosphoric AcidHCID 49779329HCID 49779329, compound

Sources & evidence

ORD record
ord-a6de75609e4347e88962df485a168e93
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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