N-(Cyclopropylmethyl)-N-(tetrahydro-2-furanylmethyl)amine

Base Information

• Chemical Name: N-(Cyclopropylmethyl)-N-(tetrahydro-2-furanylmethyl)amine
• CAS No.: 356539-57-6
• Molecular Formula: C9H17NO
• Molecular Weight: 155.24
• Hs Code.: 2932190090
• DSSTox Substance ID: DTXSID60394119
• Mol file: 356539-57-6.mol

Synonyms:356539-57-6;N-(CYCLOPROPYLMETHYL)-N-(TETRAHYDRO-2-FURANYLMETHYL)AMINE;1-cyclopropyl-N-(oxolan-2-ylmethyl)methanamine;(cyclopropylmethyl)(oxolan-2-ylmethyl)amine;1-Cyclopropyl-N-((tetrahydrofuran-2-yl)methyl)methanamine;ChemDiv2_001903;(CYCLOPROPYLMETHYL)(TETRAHYDROFURAN-2-YLMETHYL)AMINE;(cyclopropylmethyl)(tetrahydro-2-furanylmethyl)amine;Oprea1_048832;Oprea1_443695;SCHEMBL17376511;DTXSID60394119;HMS1374G11;MFCD03129360;AKOS000252867;AKOS016352354;BS-37851;CS-0236062;(cyclopropylmethyl)[(oxolan-2-yl)methyl]amine;EN300-167231;1-Cyclopropyl-N-[(oxolan-2-yl)methyl]methanamine;N-(Cyclopropylmethyl)tetrahydro-2-furanmethanamine

Chemical Property of N-(Cyclopropylmethyl)-N-(tetrahydro-2-furanylmethyl)amine

Chemical Property:

• Vapor Pressure: 0.0681mmHg at 25°C
• Boiling Point: 229.8°C at 760 mmHg
• PKA: 9.93±0.20(Predicted)
• Flash Point: 88.6°C
• PSA: 21.26000
• Density: 0.998g/cm³
• LogP: 1.55590
• XLogP3: 0.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 155.131014166
• Heavy Atom Count: 11
• Complexity: 123

Purity/Quality:

97% ^*data from raw suppliers

(cyclopropylmethyl)(tetrahydrofuran-2-ylmethyl)amine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC(OC1)CNCC2CC2

Technology Process of N-(Cyclopropylmethyl)-N-(tetrahydro-2-furanylmethyl)amine

There total 1 articles about N-(Cyclopropylmethyl)-N-(tetrahydro-2-furanylmethyl)amine 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:

C9H15NO → C9H17NO (356539-57-6)

Guidance literature:

With sodium tetrahydroborate; In methanol; dichloromethane; at 20 ℃; for 1h;

DOI:10.1016/j.bmcl.2008.11.064

Reference yield: 75.0%

C9H17NO (356539-57-6) + 4-cyano-3-methylbenzoic acid (73831-13-7) → 4-cyano-N-(cyclopropylmethyl)-3-methyl-N-((tetrahydrofuran-2-yl)methyl)benzamide

Guidance literature:

4-cyano-3-methylbenzoic acid; With triethylamine; HATU; In N,N-dimethyl-formamide; for 0.0833333h;

C₉H₁₇NO; In N,N-dimethyl-formamide; at 20 ℃; Inert atmosphere;

Reference yield:

C9H17NO (356539-57-6) → 4-(aminomethyl)-N-(cyclopropylmethyl)-3-methyl-N-((tetrahydrofuran-2-yl)methyl)benzamide

Guidance literature:

Multi-step reaction with 2 steps

1.1: HATU; triethylamine / N,N-dimethyl-formamide / 0.08 h

1.2: 20 °C / Inert atmosphere

2.1: cobalt(II) chloride hexahydrate; sodium tetrahydroborate / methanol / 1 h / 0 - 20 °C

With sodium tetrahydroborate; cobalt(II) chloride hexahydrate; triethylamine; HATU; In methanol; N,N-dimethyl-formamide;

Downstream raw materials:

C₂₁⁽¹¹⁾CH₂₅NO₂

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