2-(Pyrrolidine-1-carbonyl)cyclohexane-1-carboxylic acid

Base Information

• Chemical Name: 2-(Pyrrolidine-1-carbonyl)cyclohexane-1-carboxylic acid
• CAS No.: 414872-66-5
• Molecular Formula: C12H19NO3
• Molecular Weight: 225.28416
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID00385526
• ChEMBL ID: CHEMBL1886463
• Mol file: 414872-66-5.mol

Synonyms:414872-66-5;2-(pyrrolidine-1-carbonyl)cyclohexane-1-carboxylic acid;2-(PYRROLIDINE-1-CARBONYL)-CYCLOHEXANE-CARBOXYLIC ACID;2-(PYRROLIDIN-1-YLCARBONYL)CYCLOHEXANECARBOXYLIC ACID;2-(Pyrrolidine-1-carbonyl)cyclohexanecarboxylic acid;2-(1-pyrrolidinylcarbonyl)cyclohexanecarboxylic acid;Cambridge id 5257081;TimTec1_006416;Oprea1_001455;Oprea1_173629;MLS000713607;2-(Pyrrolidine-1-carbonyl)-cyclohexanecarboxylic acid;CHEMBL1886463;DTXSID00385526;HMS1552D14;HMS2663H23;MFCD00583193;AKOS000129300;AKOS017269418;BS-37856;SMR000273088;CS-0271527;FT-0744853;EN300-65413;AB00076932-01;2-(Pyrrolidine-1-carbonyl)cyclohexanecarboxylicacid

Chemical Property of 2-(Pyrrolidine-1-carbonyl)cyclohexane-1-carboxylic acid

Chemical Property:

• Vapor Pressure: 1.03E-08mmHg at 25°C
• Boiling Point: 433.1°C at 760 mmHg
• Flash Point: 215.7°C
• PSA: 57.61000
• Density: 1.212g/cm³
• LogP: 1.43770
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 225.13649347
• Heavy Atom Count: 16
• Complexity: 284

Purity/Quality:

98%Min ^*data from raw suppliers

2-(pyrrolidine-1-carbonyl)cyclohexane-1-carboxylicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC(C(C1)C(=O)N2CCCC2)C(=O)O