2-(Diethylamino)ethyl 4-butylaminosalicylate

Base Information

• Chemical Name: 2-(Diethylamino)ethyl 4-butylaminosalicylate
• CAS No.: 3687-99-8
• Molecular Formula: C₁₇H₂₈N₂O₃
• Molecular Weight: 308.421
• DSSTox Substance ID: DTXSID401043340
• Nikkaji Number: J90.536D
• Mol file: 3687-99-8.mol

Synonyms:2-(Diethylamino)ethyl 4-butylaminosalicylate;3687-99-8;SCHEMBL9770592;NIOSH/VO1922000;DTXSID401043340;LS-144263;S-650;VO19220000;4-n-Butylamino-salizylsaeure-diaethylaminoaethylester;4-n-Butylamino-salizylsaeure-diaethylaminoaethylester [German];Salicylic acid, 4-(butylamino)-, 2-(diethylamino)ethyl ester;Salicylic acid, p-(butylamino)-, 2-(diethylamino)ethyl ester;4-(Butylamino)-2-hydroxy-benzoic acid, 2-(diethylamino)ethyl ester;Benzoic acid, 4-(butylamino)-2-hydroxy-, 2-(diethylamino)ethyl ester

Chemical Property of 2-(Diethylamino)ethyl 4-butylaminosalicylate

Chemical Property:

• XLogP3: 4.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 11
• Exact Mass: 308.20999276
• Heavy Atom Count: 22
• Complexity: 308

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCCCNC1=CC(=C(C=C1)C(=O)OCCN(CC)CC)O

Technology Process of 2-(Diethylamino)ethyl 4-butylaminosalicylate

There total 7 articles about 2-(Diethylamino)ethyl 4-butylaminosalicylate 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:

butyraldehyde (123-72-8) → 4-butylamino-2-hydroxy-benzoic acid-(2-diethylamino-ethyl ester) (3687-99-8)

Guidance literature:

With nickel; isopropyl alcohol; Hydrogenation;

Reference yield:

→ 4-butylamino-2-hydroxy-benzoic acid-(2-diethylamino-ethyl ester) (3687-99-8)

Guidance literature:

With hydrogenchloride; palladium on activated charcoal; Hydrogenolyse;

DOI:10.1021/ja01152a032

Reference yield:

hydroxyprocaine (487-53-6) + butyraldehyde (123-72-8) → 4-butylamino-2-hydroxy-benzoic acid-(2-diethylamino-ethyl ester) (3687-99-8)

Guidance literature:

With acetic acid; zinc; benzene;

DOI:10.1021/ja01152a032

upstream raw materials:

1-bromo-butane

hydroxyprocaine

butyraldehyde

4-butylamino-2-hydroxy-benzoic acid

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