3-Formyl-4-methoxybenzoic acid

Base Information

• Chemical Name: 3-Formyl-4-methoxybenzoic acid
• CAS No.: 91420-99-4
• Molecular Formula: C9H8O4
• Molecular Weight: 180.15700
• DSSTox Substance ID: DTXSID50597637
• Wikidata: Q82493260
• Mol file: 91420-99-4.mol

Synonyms:3-Formyl-4-methoxybenzoic acid;91420-99-4;3-Formyl-4-methoxy-benzoic acid;MFCD12405165;Benzoic acid, 3-formyl-4-methoxy-;3-Formyl-4-methoxybenzoicAcid;SCHEMBL1987664;DTXSID50597637;LAQPQIRPQCMEHG-UHFFFAOYSA-N;AKOS024201201;AS-32309;SY026515;DB-079013;CS-0143798;EN300-673357;A860464;Z1255436097

Chemical Property of 3-Formyl-4-methoxybenzoic acid

Chemical Property:

• PSA: 63.60000
• LogP: 1.20590
• XLogP3: 1.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 180.04225873
• Heavy Atom Count: 13
• Complexity: 202

Purity/Quality:

97% ^*data from raw suppliers

3-Formyl-4-methoxybenzoicacid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C=C(C=C1)C(=O)O)C=O

Technology Process of 3-Formyl-4-methoxybenzoic acid

There total 3 articles about 3-Formyl-4-methoxybenzoic acid 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:

4-methoxy-3-(2,2,2-trichloro-1-hydroxy-ethyl)-benzoic acid (99184-44-8) → 3-formyl-4-methoxy-benzoic acid (91420-99-4)

Guidance literature:

With sulfuric acid;

Reference yield:

4-methoxybenzoic acid (100-09-4) → 3-formyl-4-methoxy-benzoic acid (91420-99-4)

Guidance literature:

Multi-step reaction with 2 steps

1: concentrated sulfuric acid

2: concentrated sulfuric acid

With sulfuric acid;

Reference yield:

sulfuric acid (7664-93-9) + 4-methoxy-3-(2,2,2-trichloro-1-hydroxy-ethyl)-benzoic acid (99184-44-8) → 3-formyl-4-methoxy-benzoic acid (91420-99-4)

Guidance literature:

upstream raw materials:

4-methoxy-3-(2,2,2-trichloro-1-hydroxy-ethyl)-benzoic acid

sulfuric acid

4-methoxybenzoic acid

Downstream raw materials:

3-Formyl-4-methoxybenzoesaeure-benzylester

methyl 3-formyl-4-methoxybenzoate

(2RS,6S,9S,12S)-12-<(tert-Butyloxycarbonyl)(methyl)amino>-2-hydroxy-15-methoxy-9-(1-methylpropyl)-6-phenylmethyl-4,7,10-triazabicyclo<12.3.1>octadeca-1(18),14,16-trien-5,8,11-trion

Mucronin B