Isopropylethanediol → HCID 20117356, compound

HRID 1099458Notes

Reaction equation

HRID 1099458 reaction equation
Cl[C:2]1[CH:12]=[CH:11][C:5]([C:6]([O:8]CC)=[O:7])=[CH:4][N:3]=1.[CH:13]([O:16][CH2:17][CH2:18][OH:19])([CH3:15])[CH3:14]>>[CH:13]([O:16][CH2:17][CH2:18][O:19][C:2]1[CH:12]=[CH:11][C:5]([C:6]([OH:8])=[O:7])=[CH:4][N:3]=1)([CH3:15])[CH3:14]

Participants

3

Reactant 2

HCID 7996IsopropylethanediolHCID 2799611Ethyl 6-chloronicotinate

Product 1

HCID 20117356HCID 20117356, compoundYield 51%

Procedure

The title compound was synthesized as described for Intermediate example I-92 in 51% yield starting from ethyl 6-chloronicotinate and 2-isopropoxyethanol; 1H NMR (400 MHz, DMSO-d6) δ ppm 8.70 (dd, 1 H), 8.13 (dd, 1 H), 6.91 (dd, 1 H), 4.39-4.43 (m, 2 H), 3.67-3.71 (m, 2 H), 3.55-3.65 (m, 1 H), 1.09 (d, 6 H); MS (APPI/APCI) m/z 226[M+H+].

Sources & evidence

ORD record
ord-7b810489a8f74b43ada81cab2ed89421
Source dataset
uspto-grants-2012_03
Patent number
US08143408B2

Reaction notes

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