3-Aminotetrahydrofuran

Base Information

• Chemical Name: 3-Aminotetrahydrofuran
• CAS No.: 88675-24-5
• Molecular Formula: C4H9NO
• Molecular Weight: 87.1216
• Hs Code.: 2932190090
• European Community (EC) Number: 685-688-6
• DSSTox Substance ID: DTXSID00909029
• Mol file: 88675-24-5.mol

Synonyms:3-Aminotetrahydrofuran;88675-24-5;tetrahydrofuran-3-amine;Oxolan-3-amine;Tetrahydro-furan-3-ylamine;3-amino-tetrahydrofuran;45379-55-3;3-FURANAMINE, TETRAHYDRO-;MFCD07778394;(S)-Tetrahydrofuran-3-ylamine;MFCD08234424;MFCD08234425;4-aminotetrahydrofuran;3-aminotetrahydro-furan;tetrahydrofuran-3-ylamine;rac-3-aminotetrahydrofuran;rac-tetrahydrofuran-3-amine;3-Aminotetrahydrofuran, 95%;racemic tetrahydrofuran-3-amine;(+/-)-tetrahydrofuran-3-amine;DTXSID00909029;MIPHRQMEIYLZFZ-UHFFFAOYSA-N;BCP31638;AKOS005172589;CS-W011353;PB10514;PB18852;PB27801;SB10058;SB10060;BP-10910;SY003277;SY020664;SY020665;AM20120276;FT-0600068;FT-0645739;FT-0649171;EN300-98749;(R)-tetrahydrofuran-3-amine;(3R)-oxolan-3-amine;J-511735;Z802544198

Chemical Property of 3-Aminotetrahydrofuran

Chemical Property:

• Vapor Pressure: 12.1mmHg at 25°C
• Refractive Index: 1.453
• Boiling Point: 125.6 °C at 760 mmHg
• PKA: 8.90±0.20(Predicted)
• Flash Point: 36.8 °C
• PSA: 35.25000
• Density: 0.997 g/cm³
• LogP: 0.43430
• Storage Temp.: under inert gas (nitrogen or Argon) at 2–8 °C
• XLogP3: -0.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 87.068413911
• Heavy Atom Count: 6
• Complexity: 46.8

Purity/Quality:

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

3-Aminotetrahydrofuran ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn
• Statements: 10-22-37/38-41
• Safety Statements: 26-39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1COCC1N

Technology Process of 3-Aminotetrahydrofuran

There total 4 articles about 3-Aminotetrahydrofuran 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:

3-[(benzyloxycarbonyl)amino]tetrahydrofuran (100390-87-2) → 3-aminotetrahydrofuran (88675-24-5,111769-26-7)

Guidance literature:

With hydrogen; palladium 10% on activated carbon; In methanol; hydrogen chloride; water; at 20 ℃; for 18h; under 760.051 Torr;

Reference yield:

→ 3-aminotetrahydrofuran (88675-24-5,111769-26-7)

Guidance literature:

With Pd-BaSO₄; ethanol; Hydrogenation;

DOI:10.1002/hlca.19570400404

Reference yield:

dihydro-furan-3-one oxime (18487-74-6) → 3-aminotetrahydrofuran (88675-24-5,111769-26-7)

Guidance literature:

With sodium amalgam; ethanol; acetic acid;

upstream raw materials:

dihydro-furan-3-one oxime

3-[(benzyloxycarbonyl)amino]tetrahydrofuran

Downstream raw materials:

(4S,2R,3R,5R)-2-hydroxymethyl-5-[6-(tetrahydrofuran-3-ylamino)-purin-9-yl]-tetrahydrofuran-3,4-diol

Refernces

• 1、 -. "Pyrimido?5,4-D!pyrimidines, medicaments comprising these compounds, their use and processes for their preparation". . . Retrieved 2008/06/13.