Water → HCID 20554734, compound

HRID 2347307Notes

Reaction equation

HRID 2347307 reaction equation
[CH2:28]([OH:29])[CH2:30][CH3:31].[CH3:1][N:2]([c:3]1[n:4][n:5][c:6]2[c:7]([n:8]1)[cH:9][cH:10][c:11]([Cl:13])[cH:12]2)[c:14]1[cH:15][cH:16][c:17]([O:18][CH:19]([C:20](=[O:21])[O:22][CH2:23][CH3:24])[CH3:25])[cH:26][cH:27]1.[OH2:37].[S:32](=[O:33])(=[O:34])([OH:35])[OH:36]>>[CH3:1][N:2]([c:3]1[n:4][n:5][c:6]2[c:7]([n:8]1)[cH:9][cH:10][c:11]([Cl:13])[cH:12]2)[c:14]1[cH:15][cH:16][c:17]([O:18][CH:19]([C:20](=[O:21])[O:22][CH2:23][CH2:24][CH3:28])[CH3:25])[cH:26][cH:27]1

Participants

5

Reactant 4

HCID 962WaterHCID 10311-PropanolHCID 1118Sulfuric AcidHCID 15587058HCID 15587058, compound

Product 1

HCID 20554734HCID 20554734, compound

Sources & evidence

ORD record
ord-96b711daed7849d89ecbed8e25584ddd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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