4-[(4-Chlorophenyl)methoxy]-3-methoxybenzaldehyde

Base Information

• Chemical Name: 4-[(4-Chlorophenyl)methoxy]-3-methoxybenzaldehyde
• CAS No.: 70205-04-8
• Molecular Formula: C15H13ClO3
• Molecular Weight: 276.719
• Hs Code.: 2913000090
• DSSTox Substance ID: DTXSID50352086
• Wikidata: Q82129051
• Mol file: 70205-04-8.mol

Synonyms:70205-04-8;4-[(4-chlorophenyl)methoxy]-3-methoxybenzaldehyde;4-[(4-Chlorobenzyl)Oxy]-3-Methoxybenzenecarbaldehyde;4-[(4-chlorobenzyl)oxy]-3-methoxybenzaldehyde;4-((4-Chlorobenzyl)oxy)-3-methoxybenzaldehyde;4-(4-chlorobenzyloxy)-3-methoxybenzaldehyde;4-(4-Chloro-benzyloxy)-3-methoxy-benzaldehyde;MFCD00202692;Benzaldehyde, 4-[(4-chlorophenyl)methoxy]-3-methoxy-;4-(4-Chloro-benzyloxy)-3-methoxybenzaldehyde;Cambridge id 7151510;Oprea1_281731;Oprea1_392456;SCHEMBL413085;diethyl2-cyclohexylpropanedioate;DTXSID50352086;BBL008621;STK018531;AKOS000115359;AB04738;CS-0116521;FT-0641275;EN300-01064;9H-903;A836804;4-[(4-chlorophenyl)methoxy]-3-methoxy-benzaldehyde;J-513159;Z26337246

Chemical Property of 4-[(4-Chlorophenyl)methoxy]-3-methoxybenzaldehyde

Chemical Property:

• Vapor Pressure: 2.94E-07mmHg at 25°C
• Melting Point: 88-90oC
• Boiling Point: 419.9oC at 760 mmHg
• Flash Point: 170oC
• PSA: 35.53000
• Density: 1.247g/cm3
• LogP: 3.74010
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 276.0553220
• Heavy Atom Count: 19
• Complexity: 277

Purity/Quality:

98.5% ^*data from raw suppliers

4-[(4-Chlorobenzyl)oxy]-3-methoxybenzenecarbaldehyde ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C=CC(=C1)C=O)OCC2=CC=C(C=C2)Cl

Technology Process of 4-[(4-Chlorophenyl)methoxy]-3-methoxybenzaldehyde

There total 4 articles about 4-[(4-Chlorophenyl)methoxy]-3-methoxybenzaldehyde 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: 93.0%

vanillin (121-33-5,8014-42-4) + 4-chlorobenzyl bromide (622-95-7) → 4-(4-chlorobenzyloxy)-3-methoxybenzaldehyde (70205-04-8)

Guidance literature:

With potassium carbonate; In acetonitrile; at 120 ℃; for 0.166667h; Microwaved on 300 watts;

Reference yield: 86.0%

vanillin (121-33-5,8014-42-4) → 4-(4-chlorobenzyloxy)-3-methoxybenzaldehyde (70205-04-8)

Guidance literature:

With potassium carbonate; In N,N-dimethyl-formamide; Heating;

DOI:10.3390/molecules26195770

Reference yield:

vanillin (121-33-5,8014-42-4) → 4-(4-chlorobenzyloxy)-3-methoxybenzaldehyde (70205-04-8)

Guidance literature:

vanillin; With potassium carbonate; at 20 ℃;

1-chloro-4-(halomethyl)benzene; With potassium iodide; at 25 - 110 ℃;

DOI:10.1016/j.bmcl.2020.127113

upstream raw materials:

vanillin

4-chlorobenzyl bromide

Downstream raw materials:

C₁₆H₁₆ClN₃O₂S

Refernces

• 1、 Cai, Hui,Gan, Xiuhai,Li, Shaoyuan,Song, Baoan,Wu, Qiong,Yuan, Ting. "Novel vanillin derivatives containing a 1,3,4-thiadiazole moiety as potential antibacterial agents". supporting information. . Retrieved 2020/03/24.
• 2、 -. "SUBSTITUTED 4-BENZYLOXY-PHENYLMETHYLAMIDE DERIVATIVES AS COLD MENTHOL RECEPTOR-1 (CMR-1) ANTAGONISTS FOR THE TREATMENT OF UROLOGICAL DISORDER". Page/Page column 21. . Retrieved 2008/06/13.