5-Methylfurfurylamine

Base Information

• Chemical Name: 5-Methylfurfurylamine
• CAS No.: 14003-16-8
• Molecular Formula: C6H9NO
• Molecular Weight: 111.144
• Hs Code.: 29321900
• European Community (EC) Number: 627-818-6
• DSSTox Substance ID: DTXSID40369204
• Nikkaji Number: J358.286H
• Wikidata: Q72491003
• Mol file: 14003-16-8.mol

Synonyms:14003-16-8;(5-methylfuran-2-yl)methanamine;5-Methylfurfurylamine;5-Methyl-2-furanmethanamine;(5-methyl-2-furyl)methylamine;2-Furanmethanamine, 5-methyl-;[(5-methyl-2-furyl)methyl]amine;2-Aminimethyl-5-methylfuran;1-(5-methylfuran-2-yl)methanamine;2-Aminomethyl-5-methylfuran;MFCD00143471;5-Methyl-2-furylmethylamine;5-Methylfuran-2-methanamine;SCHEMBL42698;5-Methylfurfurylamine, 97%;5-methyl-2-furanylmethanamine;5-methyl-2-furanylmethylamine;(5-methylfuran-2-yl)methylamine;DTXSID40369204;YSEAGSCGERFGBL-UHFFFAOYSA-N;(5-methylfuran-2-yl)methyl amine;(5-methyl-furan-2-ylmethyl)-amine;[(5-methyl-2-furanyl)methyl]amine;STK503367;AKOS000136861;AT17190;FS-4818;SB60869;BB 0254614;CS-0188122;FT-0620605;M1311;EN300-64144;A807615;J-007346;J-517757;F0001-0484

Chemical Property of 5-Methylfurfurylamine

Chemical Property:

• Appearance/Colour: Colorless to light yellow liquid
• Vapor Pressure: 2.3mmHg at 25°C
• Melting Point: -22 °C
• Refractive Index: n20/D 1.488(lit.)
• Boiling Point: 161.226 °C at 760 mmHg
• PKA: 9.14±0.29(Predicted)
• Flash Point: 51.308 °C
• PSA: 39.16000
• Density: 1.024 g/cm³
• LogP: 1.74700
• Water Solubility.: >1000 G/L (20 ºC)
• XLogP3: 0.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 111.068413911
• Heavy Atom Count: 8
• Complexity: 74.9

Purity/Quality:

99% ^*data from raw suppliers

(5-Methylfuran-2-yl)methanamine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi,C
• Hazard Codes: Xi,C
• Statements: 36/37/38-41-34-22
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CC1=CC=C(O1)CN

Technology Process of 5-Methylfurfurylamine

There total 7 articles about 5-Methylfurfurylamine 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: 95.0%

5-Methylfurfural (620-02-0) → 5-methylfurfurylamine (14003-16-8)

Guidance literature:

With ammonia; hydrogen; In methanol; Hexadecane; at 30 ℃; under 15001.5 Torr; High pressure; Sealed tube;

DOI:10.1002/cssc.202200192

Reference yield: 91.0%

→ 5-methylfurfurylamine (14003-16-8)

Guidance literature:

With ammonia; hydrogen; In methanol; at 90 ℃; for 4h; under 15001.5 Torr; Autoclave;

Reference yield:

furan-2-ylmethanamine (617-89-0) → 5-methylfurfurylamine (14003-16-8) + 2-hydroxymethyl-5-methylfuran (3857-25-8)

Guidance literature:

With ammonium hydroxide; 5% rhodium on activated aluminium oxide; hydrogen; at 80 ℃; for 3h; under 15001.5 Torr; Autoclave;

upstream raw materials:

(E)-2-(5-methylfuryl)aldehyde oxime

5-Methylfurfural

furan-2-ylmethanamine

furfural

Downstream raw materials:

5-Hydroxy-2-methylpyridine

4-Chloro-2-[(5-methyl-furan-2-ylmethyl)-amino]-5-sulfamoyl-benzoic acid

Refernces

• 1、 Liu, Jianguo,Ma, Longlong,Zhong, Shurong,Zhuang, Xiuzheng. "Selective catalysis for the reductive amination of furfural toward furfurylamine by graphene-co-shelled cobalt nanoparticles". . p. 271 - 284. Retrieved 2022/01/19.
• 2、 Bhanage, Bhalchandra M.,Gokhale, Tejas A.,Raut, Amol B.. "Comparative account of catalytic activity of Ru- and Ni-based nanocomposites towards reductive amination of biomass derived molecules". . . Retrieved 2021/06/18.