5-Diethylamino-2-pentanol

Base Information

• Chemical Name: 5-Diethylamino-2-pentanol
• CAS No.: 5412-69-1
• Molecular Formula: C9H21 N O
• Molecular Weight: 159.272
• Hs Code.: 2922199090
• European Community (EC) Number: 226-497-6
• NSC Number: 6321
• DSSTox Substance ID: DTXSID301310392
• Nikkaji Number: J83.293F
• Mol file: 5412-69-1.mol

Synonyms:5-Diethylamino-2-pentanol;5412-69-1;5-(diethylamino)pentan-2-ol;5-Diethylaminopentan-2-ol;2-Pentanol, 5-(diethylamino)-;EINECS 226-497-6;C9H21NO;NSC6321;5-(Diethylamino)-2-pentanol;SCHEMBL557630;OAQYRNDEOJQVBN-UHFFFAOYSA-;DTXSID301310392;NSC 6321;NSC-6321;AKOS009157273;FT-0635683;A829975;W-110035

Chemical Property of 5-Diethylamino-2-pentanol

Chemical Property:

• Vapor Pressure: 0.0264mmHg at 25°C
• Refractive Index: 1.444-1.446
• Boiling Point: 218.6°C at 760 mmHg
• Flash Point: 70.2°C
• PSA: 23.47000
• Density: 0.86
• LogP: 1.48920
• XLogP3: 1.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 6
• Exact Mass: 159.162314293
• Heavy Atom Count: 11
• Complexity: 81.6

Purity/Quality:

98% ^*data from raw suppliers

5-Diethylaminopentan-2-ol ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 24/25

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN(CC)CCCC(C)O

Technology Process of 5-Diethylamino-2-pentanol

There total 14 articles about 5-Diethylamino-2-pentanol 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:

4-hydroxy-valeric acid diethylamide (112146-12-0) → 5-diethylaminopentan-2-ol (5412-69-1,415679-47-9,415679-46-8)

Guidance literature:

With diisobutylaluminium hydride; In tetrahydrofuran; at 0 - 20 ℃; for 3h; Inert atmosphere;

DOI:10.1039/c2ob25901j

Reference yield:

diethyl(4-trityloxypentyl)amine → 5-diethylaminopentan-2-ol (5412-69-1,415679-47-9,415679-46-8)

Guidance literature:

With naphthalene; lithium; In tetrahydrofuran; at -78 ℃; for 3.8h;

DOI:10.1055/s-2003-41057

Reference yield:

5-methyl-dihydro-furan-2-one (108-29-2) → 5-diethylaminopentan-2-ol (5412-69-1,415679-47-9,415679-46-8)

Guidance literature:

Multi-step reaction with 2 steps

1: tetrahydrofuran / 0.5 h / 20 °C / Inert atmosphere

2: diisobutylaluminium hydride / tetrahydrofuran / 3 h / 0 - 20 °C / Inert atmosphere

With diisobutylaluminium hydride; In tetrahydrofuran;

DOI:10.1039/c2ob25901j

upstream raw materials:

5-diethylamino-2-pentanone

1,4-Pentanediol

diethylamine

5-chloro-2-pentanol

Downstream raw materials:

Benzo[d]isoxazol-3-yl-cyclohexyl-acetic acid 4-diethylamino-1-methyl-butyl ester

Diethyl-{4-[phenyl-(3-trifluoromethyl-phenyl)-methoxy]-pentyl}-amine

Diethyl-{4-[phenyl-(2-trifluoromethyl-phenyl)-methoxy]-pentyl}-amine

5-diethylamino-2-pentylamine

Refernces

• 1、 Yus, Miguel,Behloul, Cherif,Guijarro, David. "Detritylation Procedure under Non-Acidic Conditions: Naphthalene Catalysed Reductive Cleavage of Trityl Ethers". . p. 2179 - 2184. Retrieved 2007/10/03.