2-(3-Propoxyphenyl)ethanamine

Base Information

• Chemical Name: 2-(3-Propoxyphenyl)ethanamine
• CAS No.: 103686-13-1
• Molecular Formula: C11H18ClNO
• Molecular Weight: 179.26
• European Community (EC) Number: 831-120-9
• Mol file: 103686-13-1.mol

Synonyms:2-(3-propoxyphenyl)ethanamine;103686-13-1;2-(3-propoxyphenyl)ethan-1-amine;SCHEMBL1047449;2-(3-propyloxyphenyl)ethylamine;CDJFWESZVLIVIS-UHFFFAOYSA-N;MFCD08449852;AKOS005646818;NCGC00325935-01;EN300-113372;G30147;AB01320958-02;Z600593058

Chemical Property of 2-(3-Propoxyphenyl)ethanamine

Chemical Property:

• Boiling Point: 281.7±15.0 °C(Predicted)
• PKA: 9.85±0.10(Predicted)
• PSA: 35.25000
• Density: 0.979±0.06 g/cm3(Predicted)
• LogP: 3.47890
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 179.131014166
• Heavy Atom Count: 13
• Complexity: 127

Purity/Quality:

98%min ^*data from raw suppliers

2-(3-Propoxyphenyl)ethan-1-amine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCOC1=CC=CC(=C1)CCN

Technology Process of 2-(3-Propoxyphenyl)ethanamine

There total 2 articles about 2-(3-Propoxyphenyl)ethanamine 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:

1-((E)-2-Nitro-vinyl)-3-propoxy-benzene → 2-(3-propyloxyphenyl)ethylamine (103686-13-1)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran;

DOI:10.1021/jm00025a010

Reference yield:

→ 2-(3-propyloxyphenyl)ethylamine (103686-13-1)

Guidance literature:

Reference yield: 56.0%

4-(aminosulfonyl)-benzoic acid (138-41-0) + 2-(3-propyloxyphenyl)ethylamine (103686-13-1) → 4-(aminosulfonyl)-N-[2-(3-propoxyphenyl)ethyl]benzamide (1372808-80-4)

Guidance literature:

4-(aminosulfonyl)-benzoic acid; With O-(1H-benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium hexafluorophosphate; In N,N-dimethyl-formamide; at 20 ℃; for 1h;

2-(3-propyloxyphenyl)ethylamine; With triethylamine; In N,N-dimethyl-formamide; at 20 ℃;

DOI:10.1021/jm300112w

Downstream raw materials:

1-[2-(3-Propoxy-phenyl)-ethyl]-3-thiazol-2-yl-thiourea

4-(aminosulfonyl)-N-[2-(3-propoxyphenyl)ethyl]benzamide