1-carbamoylcyclobutane-1-carboxylic Acid

Base Information

• Chemical Name: 1-carbamoylcyclobutane-1-carboxylic Acid
• CAS No.: 845621-11-6
• Molecular Formula: C6H9 N O3
• Molecular Weight: 143.142
• Hs Code.: 2924299090
• European Community (EC) Number: 696-259-8
• DSSTox Substance ID: DTXSID60463990
• Wikidata: Q82289136
• Mol file: 845621-11-6.mol

Synonyms:845621-11-6;Cyclobutane-1,1-dicarboxylic acid monoamide;1-carbamoylcyclobutane-1-carboxylic Acid;1-(Aminocarbonyl)-cyclobutanecarboxylic acid;SCHEMBL10332168;DTXSID60463990;MFCD04114274;(1-Carbamoyl)cyclobutylcarboxylic Acid;AKOS011375893;AB92165;FG-0705;1-(2-CHLOROPHENYL)CYCLOPROPYLAMINE;CS-0149988;FT-0630058;EN300-68747;A848576;Cyclobutane-1 pound not1-dicarboxylic acid monoamide;Z951182682

Chemical Property of 1-carbamoylcyclobutane-1-carboxylic Acid

Chemical Property:

• Vapor Pressure: 3.32E-08mmHg at 25°C
• Boiling Point: 419.3°C at 760 mmHg
• PKA: 4.07±0.20(Predicted)
• Flash Point: 207.4°C
• PSA: 80.39000
• Density: 1.43g/cm³
• LogP: 0.42690
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: -0.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 143.058243149
• Heavy Atom Count: 10
• Complexity: 183

Purity/Quality:

97% ^*data from raw suppliers

Cyclobutane-1,1-dicarboxylicAcidMonoamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC(C1)(C(=O)N)C(=O)O

Technology Process of 1-carbamoylcyclobutane-1-carboxylic Acid

There total 1 articles about 1-carbamoylcyclobutane-1-carboxylic Acid 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: 72.0%

ethyl 1-cyano-1-cyclobutanecarboxylate (28246-87-9) → C6H9NO3 (845621-11-6)

Guidance literature:

ethyl 1-cyano-1-cyclobutanecarboxylate; With sodium hydroxide; water; at 45 ℃; for 0.5h;

With dihydrogen peroxide; at 20 - 25 ℃; for 1.5h;

With hydrogenchloride; In water; pH=3.0;

Reference yield: 70.0%

C6H9NO3 (845621-11-6) → 1-aminocyclobutane-1-carboxylic acid (22264-50-2)

Guidance literature:

C₆H₉NO₃; With sodium hydroxide; sodium hypochlorite; In water; at 5 ℃; for 1h;

With hydrogenchloride; In water; at 15 - 25 ℃; for 3h;

With hydrogenchloride; In water; pH=7.0;

upstream raw materials:

ethyl 1-cyano-1-cyclobutanecarboxylate

Downstream raw materials:

1-aminocyclobutane-1-carboxylic acid