1-Pentanol, 5-(p-aminophenoxy)-

Base Information

• Chemical Name: 1-Pentanol, 5-(p-aminophenoxy)-
• CAS No.: 100055-08-1
• Molecular Formula: C11H17 N O2
• Molecular Weight: 195.261
• DSSTox Substance ID: DTXSID00142893
• Mol file: 100055-08-1.mol

Synonyms:1-Pentanol, 5-(p-aminophenoxy)-;100055-08-1;5-(p-Aminophenoxy)-1-pentanol;M & B 2729;BRN 3254642;5-(4-aminophenoxy)pentan-1-ol;DTXSID00142893;AKOS011511216;LS-101872

Chemical Property of 1-Pentanol, 5-(p-aminophenoxy)-

Chemical Property:

• Vapor Pressure: 4.01E-06mmHg at 25°C
• Boiling Point: 369.8°C at 760 mmHg
• Flash Point: 177.5°C
• Density: 1.089g/cm³
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 195.125928785
• Heavy Atom Count: 14
• Complexity: 133

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC(=CC=C1N)OCCCCCO

Technology Process of 1-Pentanol, 5-(p-aminophenoxy)-

There total 3 articles about 1-Pentanol, 5-(p-aminophenoxy)- 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: 45.0%

4-(4-formylbutyloxy)nitrobenzene (374588-21-3) → 4-(5-hydroxypentyloxy)aniline (100055-08-1) + 2,13-dioxa-8,19-diazatricyclo[18.2.2.29,12]hexacosa-10,11,20,22,23,25-hexaene

Guidance literature:

With hydrogen; palladium on activated charcoal; In methanol; at 15 - 20 ℃; for 24h; under 760 Torr;

DOI:10.1016/S0040-4020(01)00716-5

Reference yield:

1‐(but‐3‐en‐1‐yloxy)‐4‐nitrobenzene (40742-21-0) → 4-(5-hydroxypentyloxy)aniline (100055-08-1)

Guidance literature:

Multi-step reaction with 2 steps

1: H₂; [Rh(OAc)2]2; PPh₃ / 20 h / 20685.9 Torr

2: 45 percent / H₂ / 10 percent Pd/C / methanol / 24 h / 15 - 20 °C / 760 Torr

With dirhodium tetraacetate; hydrogen; triphenylphosphine; palladium on activated charcoal; In methanol;

DOI:10.1016/S0040-4020(01)00716-5

Reference yield:

1-acetoxy-5-(4-amino-phenoxy)-pentane (100619-14-5) → 4-(5-hydroxypentyloxy)aniline (100055-08-1)

Guidance literature:

With hydrogenchloride;

upstream raw materials:

1-acetoxy-5-(4-amino-phenoxy)-pentane

4-(4-formylbutyloxy)nitrobenzene

1‐(but‐3‐en‐1‐yloxy)‐4‐nitrobenzene

Downstream raw materials:

acetic acid-[4-(5-hydroxy-pentyloxy)-anilide]