Methanol → Dimethyl 4-[3-(3-ethyl-4-hydroxyphenyl)propyl]phthalate

HRID 104868Notes

Reaction equation

HRID 104868 reaction equation
[CH2:1]([O:2][CH2:3][O:5][c:6]1[c:7]([CH2:29][CH3:30])[cH:8][c:9]([CH2:12][CH2:13][CH2:14][c:15]2[cH:16][c:17]([C:25](=[O:26])[O:27][CH3:28])[c:18]([C:19](=[O:20])[O:21][CH3:22])[cH:23][cH:24]2)[cH:10][cH:11]1)[CH3:4].[CH3:37][OH:38].[OH2:36].[S:31](=[O:32])(=[O:33])([OH:34])[OH:35]>>[OH:5][c:6]1[c:7]([CH2:29][CH3:30])[cH:8][c:9]([CH2:12][CH2:13][CH2:14][c:15]2[cH:16][c:17]([C:25](=[O:26])[O:27][CH3:28])[c:18]([C:19](=[O:20])[O:21][CH3:22])[cH:23][cH:24]2)[cH:10][cH:11]1

Participants

5

Reactant 4

HCID 887MethanolHCID 962WaterHCID 1118Sulfuric AcidHCID 17983048Dimethyl 4-[3-(4-ethoxymethoxy-3-ethylphenyl)propyl]phthalate

Product 1

HCID 17983037Dimethyl 4-[3-(3-ethyl-4-hydroxyphenyl)propyl]phthalate

Sources & evidence

ORD record
ord-6dd1c772c25848fa90b1060c79762fb0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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