Tetrahydrofuran → Methyl 3-(hydroxymethyl)-5-[(methylsulfonyl)(propyl)amino]benzoate

HRID 1119366Notes

Reaction equation

HRID 1119366 reaction equation
[CH2:37]([I:38])[CH2:39][CH3:40].[CH2:41]1[O:42][CH2:43][CH2:44][CH2:45]1.[CH3:1][O:2][C:3](=[O:4])[c:5]1[cH:6][c:7]([C:8](=[O:9])[OH:10])[cH:11][c:12]([N:14]([CH2:15][CH2:16][CH3:17])[S:18](=[O:19])(=[O:20])[CH3:21])[cH:13]1.[NH2:22][c:23]1[cH:24][c:25]([C:26]([O:27][CH3:28])=[O:29])[cH:30][c:31]([C:33]([O:34][CH3:35])=[O:36])[cH:32]1>>[CH3:1][O:2][C:3](=[O:4])[c:5]1[cH:6][c:7]([CH2:8][OH:9])[cH:11][c:12]([N:14]([CH2:15][CH2:16][CH3:17])[S:18](=[O:19])(=[O:20])[CH3:21])[cH:13]1

Participants

5

Reactant 4

HCID 8028TetrahydrofuranHCID 336431-IodopropaneHCID 66831Dimethyl 5-aminoisophthalateHCID 592118953-(Methoxycarbonyl)-5-[(methylsulfonyl)(propyl)amino]benzoic acid

Product 1

HCID 57775670Methyl 3-(hydroxymethyl)-5-[(methylsulfonyl)(propyl)amino]benzoate

Sources & evidence

ORD record
ord-d2d244132af9463fa38df66b03edcaba
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

Loading…