N-Methylbutylamine

Base Information

• Chemical Name: N-Methylbutylamine
• CAS No.: 110-68-9
• Molecular Formula: C5H13 N
• Molecular Weight: 87.1649
• Hs Code.: 29211999
• European Community (EC) Number: 203-791-2
• UN Number: 2945
• UNII: 61NTK0473L
• DSSTox Substance ID: DTXSID9059389
• Nikkaji Number: J35.114H
• Wikidata: Q6036776
• Metabolomics Workbench ID: 60350
• Mol file: 110-68-9.mol

Synonyms:N-Methylbutylamine;110-68-9;N-Butylmethylamine;Methylbutylamine;N-Methyl-N-butylamine;Butylmethylamine;N-Butyl-N-methylamine;N-methylbutan-1-amine;1-Butanamine, N-methyl-;N-Methylbutanamine;N-METHYL BUTYLAMINE;N-methyl-1-butanamine;Butylamine, N-methyl-;Butyl(Methyl)Amine;N-(Methyl) butyl amine;Butanamine, N-methyl-;Methyl-N-butylamine;Methylaminobutane;butyl-methyl-amine;UN2945;N-methyl butyl amine;HSDB 2748;N-Methyl-1-butylamine;EINECS 203-791-2;UNII-61NTK0473L;61NTK0473L;MFCD00009426;6973-82-6;butilmetilamina;metilbutilamina;Metilaminobutano;butylmethyl amine;N-butilmetilamina;N-metilbutilamina;N-Metilbutanamina;N-Mthylbutylamine;butyl methyl amine;NMBuA;N-methyl-butylamine;N-n-butylmethylamine;n-butyl-methyl-amine;N-metil-n-butilamina;Methylbutylamine, N-;N-butil-N-metilamina;N-metil-1-butanamina;Butilamina, N-metil-;N-methylbutane-1-amine;N-butyl-N-methyl-amine;N-n-butyl-N-methylamine;1-butanamina, N-metil-;N-Butylmethylamine, 96%;DTXSID9059389;CHEBI:59019;N-METHYL BUTYLAMINE [HSDB];Butylamine N-methyl-(6CI7CI8CI);STR01458;NA2945;AKOS000119856;UN 2945;LS-47425;FT-0631618;M0179;EN300-18954;D91287;N-Methylbutylamine [UN2945] [Flammable liquid];N-Methylbutylamine [UN2945] [Flammable liquid];Q6036776;W-108686;F2190-0308

Chemical Property of N-Methylbutylamine

Chemical Property:

• Appearance/Colour: CLEAR COLOURLESS LIQUID
• Vapor Pressure: 53.7mmHg at 25°C
• Melting Point: -75 °C
• Refractive Index: n20/D 1.3995(lit.)
• Boiling Point: 90.5-91.5 °C(lit.)
• PKA: pK1: 10.90(+1) (25°C)
• Flash Point: 1.7°C
• PSA: 12.03000
• Density: 0.736
• LogP: 1.39680
• Storage Temp.: Flammables area
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 87.104799419
• Heavy Atom Count: 6
• Complexity: 19.9
• Transport DOT Label: Flammable Liquid Corrosive

Purity/Quality:

98%min ^*data from raw suppliers

N-Methylbutylamine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Flammable, dangerous fire risk.
• Hazard Codes: F,C
• Statements: 11-20/21/22-34
• Safety Statements: 16-26-36/37/39-45

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Chemical Classes: Nitrogen Compounds -> Amines, Aliphatic
• Canonical SMILES: CCCCNC
• Uses: Intermediate.

Technology Process of N-Methylbutylamine

There total 58 articles about N-Methylbutylamine 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: 84.0%

formaldehyd (50-00-0,30525-89-4,61233-19-0) + N-butylamine (109-73-9,85404-21-3) → N-n-butyl-N-methylamine (110-68-9)

Guidance literature:

With sodium dihydrogenphosphate; zinc; at 30 ℃; for 4h;

DOI:10.1016/j.tetlet.2007.08.092

Reference yield: 78.0%

(Methyl-butyl-amino)-diphenyl-phosphinoxid (98579-83-0) → N-n-butyl-N-methylamine (110-68-9)

Guidance literature:

(Methyl-butyl-amino)-diphenyl-phosphinoxid; With hydrogenchloride; In water; at 20 - 25 ℃; for 3h;

With sodium hydroxide; In dichloromethane; at 20 - 25 ℃; for 1h;

DOI:10.1007/s11172-009-0256-3

Reference yield: 70.0%

RuCl2(N,N′-bis(mesityl)imidazolin-2-ylidene)(PCy3)(=CH2) + N-butylamine (109-73-9,85404-21-3) → N-n-butyl-N-methylamine (110-68-9) + methyltricyclohexylphosphonium chloride

Guidance literature:

In benzene; at 20 ℃; for 0.166667h; Inert atmosphere; Schlenk technique; Glovebox;

DOI:10.1039/c4cy01118j

upstream raw materials:

pyridine

N,N-dimethylbutylamine

dibenzoyl peroxide

N-butylformamide

Downstream raw materials:

N-(2-aminophenyl)-2-(N-methyl-N-n-butylamino)acetamide

N-Butyl-N-methylbenzenemethanamine

butyl-[3-(4-methoxy-phenyl)-[1,2,4]oxadiazol-5-ylmethyl]-methyl-amine

methyl-(3-phenyl-propyl)-amine

Refernces

• 1、 Lummiss, Justin A. M.,Botti, Adrian G. G.,Fogg, Deryn E.. "Isotopic probes for ruthenium-catalyzed olefin metathesis". . p. 4210 - 4218. Retrieved 2014.
• 2、 Sommers,Aaland. "-". . p. 484. Retrieved 1956.
• 3、 Smith Jr.,Denlinger,Kupper,Koepke,Michejda. "SPECIFIC ACID CATALYSIS IN THE DECOMPOSITION OF TRIALKYLTRIAZENES.". . p. 1056 - 1059. Retrieved 1984.
• 4、 Matzel, Philipp,Krautschick, Lukas,H?hne, Matthias. "Photometric Characterization of the Reductive Amination Scope of the Imine Reductases from Streptomyces tsukubaensis and Streptomyces ipomoeae". . p. 2022 - 2027. Retrieved 2017/10/07.
• 5、 Su, Jiahui,Li, Xungang,Chen, Yunbin,Cui, Yuancun,Xu, Jingwei,Qian, Chao,Chen, Xinzhi. "N-Methylation of amines with methanol in a hydrogen free system on a combined Al2O3-mordenite catalyst". . p. 55643 - 55649. Retrieved 2016/07/06.