Benzoic acid, 4-[[(2-formyl-3-pyridinyl)oxy]methyl]-, methyl ester

Base Information

Chemical Name:Benzoic acid, 4-[[(2-formyl-3-pyridinyl)oxy]methyl]-, methyl ester
CAS No.:136423-87-5
Molecular Formula:C₁₅H₁₃NO₄
Molecular Weight:271.273
Hs Code.:
DSSTox Substance ID:DTXSID801165318

Synonyms:Benzoic acid, 4-[[(2-formyl-3-pyridinyl)oxy]methyl]-, methyl ester;136423-87-5;SCHEMBL15065516;DTXSID801165318

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Chemical Property of Benzoic acid, 4-[[(2-formyl-3-pyridinyl)oxy]methyl]-, methyl ester

Chemical Property:

XLogP3:2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:271.08445790
Heavy Atom Count:20
Complexity:326

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:COC(=O)C1=CC=C(C=C1)COC2=C(N=CC=C2)C=O

Technology Process of Benzoic acid, 4-[[(2-formyl-3-pyridinyl)oxy]methyl]-, methyl ester

There total 4 articles about Benzoic acid, 4-[[(2-formyl-3-pyridinyl)oxy]methyl]-, methyl ester which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 78.0%

: 136423-84-2
methyl 4-<(2-hydroxymethyl-3-pyridinyloxy)methyl>benzoate

: 136423-87-5
methyl 4-<(2-formyl-3-pyridinyloxy)methyl>benzoate

Guidance literature:: With manganese(IV) oxide; In 1,2-dimethoxyethane; at 100 ℃; for 1h;
DOI:10.1016/0223-5234(91)90107-X

Reference yield:

: 2417-72-3
Methyl 4-(bromomethyl)benzoate

: 136423-87-5
methyl 4-<(2-formyl-3-pyridinyloxy)methyl>benzoate

Guidance literature:: Multi-step reaction with 2 steps

1: 1.) EtONa / 1.) ethanol, RT, 1 h, 2.) DMSO, RT, overnight

2: 78 percent / MnO₂ / 1,2-dimethoxy-ethane / 1 h / 100 °C

With manganese(IV) oxide; sodium ethanolate; In 1,2-dimethoxyethane;
DOI:10.1016/0223-5234(91)90107-X

Reference yield:

: 14173-30-9
3-hydroxy-2-hydroxymethylpyridine hydrochloride

: 136423-87-5
methyl 4-<(2-formyl-3-pyridinyloxy)methyl>benzoate

Guidance literature:: Multi-step reaction with 2 steps

1: 1.) EtONa / 1.) ethanol, RT, 1 h, 2.) DMSO, RT, overnight

2: 78 percent / MnO₂ / 1,2-dimethoxy-ethane / 1 h / 100 °C

With manganese(IV) oxide; sodium ethanolate; In 1,2-dimethoxyethane;
DOI:10.1016/0223-5234(91)90107-X