1-(3-Ethoxyphenyl)methanamine

Base Information

• Chemical Name: 1-(3-Ethoxyphenyl)methanamine
• CAS No.: 93071-76-2
• Molecular Formula: C9H13 N O
• Molecular Weight: 151.208
• Hs Code.: 2922299090
• DSSTox Substance ID: DTXSID40426806
• Mol file: 93071-76-2.mol

Synonyms:1-(3-ethoxyphenyl)methanamine;93071-76-2;(3-ethoxyphenyl)methanamine;3-Ethoxybenzylamine;Benzenemethanamine,3-ethoxy-;(3-ethoxybenzyl)amine;SCHEMBL606214;3-ethoxybenzylamine, AldrichCPR;DTXSID40426806;ORFDOJUUDDVASP-UHFFFAOYSA-N;MFCD03410991;STK500976;AKOS000140669;SB76612;LS-02009;BB 0254369;FT-0647346;EN300-41941;N12140;Z239604652

Chemical Property of 1-(3-Ethoxyphenyl)methanamine

Chemical Property:

• Vapor Pressure: 0.0244mmHg at 25°C
• Refractive Index: 1.525
• Boiling Point: 248.3°C at 760 mmHg
• Flash Point: 105.8°C
• PSA: 35.25000
• Density: 1.008g/cm³
• LogP: 2.24430
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 151.099714038
• Heavy Atom Count: 11
• Complexity: 106

Purity/Quality:

98%,99%, ^*data from raw suppliers

3-Ethoxybenzylamine 98% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn
• Statements: 22

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC1=CC=CC(=C1)CN

Technology Process of 1-(3-Ethoxyphenyl)methanamine

There total 4 articles about 1-(3-Ethoxyphenyl)methanamine 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:

3-ethoxy-thiobenzoic acid amide (747411-11-6) → (3-ethoxyphenyl)methanamine (93071-76-2)

Guidance literature:

With hydrogenchloride; zinc;

DOI:10.1021/ja01306a048

Reference yield:

3-(ethyloxy)benzonitrile (25117-75-3) → (3-ethoxyphenyl)methanamine (93071-76-2)

Guidance literature:

Multi-step reaction with 2 steps

1: ethanol; ammonia; hydrogen sulfide / Erhitzen des erhaltenen Reaktionsgemisches im geschlossenen Gefaess auf 105grad

2: zinc; aq.-ethanolic hydrochloric acid

With hydrogenchloride; ethanol; hydrogen sulfide; ammonia; zinc;

DOI:10.1021/ja01306a048

Reference yield:

m-phenetidine (621-33-0) → (3-ethoxyphenyl)methanamine (93071-76-2)

Guidance literature:

Multi-step reaction with 3 steps

1: sodium nitrite; aqueous hydrochloric acid / Eintragen der Diazoniumsalz-Loesung in eine warme, aus Kupfer(II)-sulfat, Kaliumcyanid und wss. Ammoniak (oder Wasser) hergestellte Loesung

2: ethanol; ammonia; hydrogen sulfide / Erhitzen des erhaltenen Reaktionsgemisches im geschlossenen Gefaess auf 105grad

3: zinc; aq.-ethanolic hydrochloric acid

With hydrogenchloride; ethanol; hydrogen sulfide; ammonia; zinc; sodium nitrite;

DOI:10.1021/ja01306a048

upstream raw materials:

3-ethoxy-thiobenzoic acid amide

3-(ethyloxy)benzonitrile

m-phenetidine

Downstream raw materials:

1-(3-ethoxybenzyl)-3-(4-(pyridin-4-yl)thiazol-2-yl)urea

N-(3-ethoxybenzyl)-4-(2-((trans-4-acetylamino-cyclohexyl)methyl)-2H-tetrazol-5-yl)-6-methyl-picolinamide

N-(3-ethoxy-benzyl)-4-(2-((trans-4-methylsulfonylamino-cyclohexyl)methyl)-2H-tetrazol-5-yl)-6-methyl-picolinamide

(1-butyl-2-iodo-4-phenyl-3H-imidazol-5-ylmethyl)-(3-ethoxy-benzyl)-amine