2-Cyclopropyl-2-hydroxyacetonitrile

Base Information

• Chemical Name: 2-Cyclopropyl-2-hydroxyacetonitrile
• CAS No.: 5648-87-3
• Molecular Formula: C5H7NO
• Molecular Weight: 97.1167
• European Community (EC) Number: 873-548-9
• ChEMBL ID: CHEMBL2271406
• Nikkaji Number: J1.811.232I
• Mol file: 5648-87-3.mol

Synonyms:2-cyclopropyl-2-hydroxyacetonitrile;5648-87-3;Cyclopropylcarboxaldehyde;Cyclopropaneacetonitrile, a-hydroxy-;cyclopropylcarboxaldehye;cylopropyl carboxaldehyde;cyclopropyl carboxaldehyde;cyclopropyl-carboxaldehyde;CHEMBL2271406;ILJKKAIQFPEIBL-UHFFFAOYSA-N;MFCD14622836;AKOS010564531;CS-0254618;EN300-96207;E82575

Chemical Property of 2-Cyclopropyl-2-hydroxyacetonitrile

Chemical Property:

• PSA: 44.02000
• LogP: 0.28088
• XLogP3: 0.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 97.052763847
• Heavy Atom Count: 7
• Complexity: 109

Purity/Quality:

95% ^*data from raw suppliers

cyclopropyl(hydroxy)acetonitrile ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC1C(C#N)O

Technology Process of 2-Cyclopropyl-2-hydroxyacetonitrile

There total 7 articles about 2-Cyclopropyl-2-hydroxyacetonitrile 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: 61.0%

Cyclopropylmethanol (2516-33-8) + 2-hydroxy-2-methylpropanenitrile (75-86-5) → 2-cyclopropyl-2-hydroxyacetonitrile (5648-87-3)

Guidance literature:

In dichloromethane;

Reference yield:

→ 2-cyclopropyl-2-hydroxyacetonitrile (5648-87-3) + hydrogen cyanide (74-90-8)

Guidance literature:

at 500 ℃; Beim Leiten ueber mit Natriumdihydrogenphosphat und Phosphorsaeure impraegnierten Bimsstein;

DOI:10.1039/jr9450000052

Reference yield:

2-tetrahydrofuran-2-carbonitrile (14631-43-7) → 2-cyclopropyl-2-hydroxyacetonitrile (5648-87-3) + hydrogen cyanide (74-90-8)

Guidance literature:

at 500 ℃; Leiten ueber mit Natriumdihydrogenphosphat und Phosphorsaeure impraegnierten Bimsstein;

DOI:10.1039/jr9450000052

upstream raw materials:

2-tetrahydrofuran-2-carbonitrile

potassium cyanide

Cyclopropanecarboxaldehyde

trimethylsilyl cyanide

Downstream raw materials:

3-benzyloxy-5-cyclopropyl-4-imino-oxazolidin-2-one

3-(4-cyanophenyl)-5-cyclopropyl-4-iminooxazolidin-2-one

3-(4-cyanophenyl)-5-cyclopropyloxazolidin-2,4-dione

3-benzyloxy-5-cyclopropyl-oxazolidin-2,4-dione