5-Benzylamino-1-pentanol

Base Information

• Chemical Name: 5-Benzylamino-1-pentanol
• CAS No.: 2937-99-7
• Molecular Formula: C12H19NO
• Molecular Weight: 193.289
• European Community (EC) Number: 679-546-2
• DSSTox Substance ID: DTXSID10589396
• Nikkaji Number: J2.544.048J
• Wikidata: Q82482743
• Mol file: 2937-99-7.mol

Synonyms:5-Benzylamino-1-pentanol;2937-99-7;5-(benzylamino)pentan-1-ol;1-Pentanol, 5-[(phenylmethyl)amino]-;5-(benzylamino)-1-pentanol;N-(5-Hydroxypentyl)benzylamine;N-(5-Hydroxyamyl)benzylamine;SCHEMBL7984635;DTXSID10589396;YMNRQBMCCMQGSH-UHFFFAOYSA-N;CAA93799;MFCD09688387;STK512276;AKOS001481094;DB-206572;B3461;CS-0316253;D89016;AN-465/43422226

Chemical Property of 5-Benzylamino-1-pentanol

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Refractive Index: 1.5270-1.5310
• Boiling Point: 312.258°C at 760 mmHg
• Flash Point: 100.753°C
• PSA: 32.26000
• Density: 0.993g/cm³
• LogP: 2.32970
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 7
• Exact Mass: 193.146664230
• Heavy Atom Count: 14
• Complexity: 122

Purity/Quality:

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

5-Benzylamino-1-pentanol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)CNCCCCCO

Technology Process of 5-Benzylamino-1-pentanol

There total 12 articles about 5-Benzylamino-1-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: 82.0%

5-hydroxypentylamine (2508-29-4) + benzaldehyde (100-52-7) → N-benzyl-5-aminopentan-1-ol (2937-99-7)

Guidance literature:

5-hydroxypentylamine; benzaldehyde; With sodium sulfate; In dichloromethane; at 20 ℃; for 18h; Inert atmosphere;

With sodium tetrahydroborate; In ethanol; at 0 - 20 ℃; for 6h;

DOI:10.3762/bjoc.8.232

Reference yield: 20.6%

5-chloropentan-1-ol (5259-98-3) + benzylamine (100-46-9) → N-benzyl-5-aminopentan-1-ol (2937-99-7)

Guidance literature:

With potassium carbonate; In acetonitrile; at 80 ℃; for 48h;

DOI:10.1016/j.bmc.2017.11.016

Reference yield:

1,5-dibromo-pentane (111-24-0) + benzylamine (100-46-9) → N-benzyl-5-aminopentan-1-ol (2937-99-7) + N1,N5-dibenzylpentane-1,5-diamine (41640-76-0) + C17H28NO(1+)*Br(1-) + N-Benzylpiperidine (2905-56-8)

Guidance literature:

With sodium hydroxide; In 2-methyltetrahydrofuran; water; at 120 ℃; for 0.333333h; Temperature; Microwave irradiation;

DOI:10.1039/c6gc02840c

upstream raw materials:

3,4-dihydro-2H-pyran

benzylamine

5-{[1-Phenyl-meth-(E)-ylidene]-amino}-pentan-1-ol

5-hydroxypentylamine

Downstream raw materials:

[(4-benzyl-2-{1-[benzyl-(5-hydroxy-pentyl)-amino]-heptyl}-oxazol-5-yl)-methyl-amino]-acetic acid methyl ester

4-(phenylcarboxymethyl)benzyl N-benzyl-N-(5-(3-O-benzyl-2-O-benzoyl-4-O-levulinoyl-6-O-tert-butyldiphenylsilyl-α-L-idopyranosyloxy)pentyl)carbamate

4-(hydroxymethyl)benzyl N-benzyl-N-(5-(3-O-benzyl-2-O-benzoyl-4-O-levulinoyl-6-O-tert-butyldiphenylsilyl-α-L-idopyranosyloxy)pentyl)carbamate

4-(phenylcarboxymethyl)benzyl N-benzyl-N-(5-((3-O-benzyl-2-O-benzoyl-4-O-levulinoyl-α-L-idopyranosyloxy)uronate)pentyl)carbamate

Refernces

• 1、 Dei, Silvia,Romanelli, Maria Novella,Manetti, Dina,Chiaramonte, Niccolò,Coronnello, Marcella,Salerno, Milena,Teodori, Elisabetta. "Design and synthesis of aminoester heterodimers containing flavone or chromone moieties as modulators of P-glycoprotein-based multidrug resistance (MDR)". . p. 50 - 64. Retrieved 2017/11/29.
• 2、 Mandrelli, Francesca,Buco, Alessia,Piccioni, Lorenzo,Renner, Florian,Guelat, Bertrand,Martin, Benjamin,Schenkel, Berthold,Venturoni, Francesco. "The scale-up of continuous biphasic liquid/liquid reactions under super-heating conditions: Methodology and reactor design". . p. 1425 - 1430. Retrieved 2017/05/10.