Ethyl 3-amino-7-oxabicyclo[2.2.1]heptane-2-carboxylate

Base Information

• Chemical Name: Ethyl 3-amino-7-oxabicyclo[2.2.1]heptane-2-carboxylate
• CAS No.: 1212263-59-6
• Molecular Formula: C9H11NO5
• Molecular Weight: 213.18734
• DSSTox Substance ID: DTXSID80588775
• Mol file: 1212263-59-6.mol

Synonyms:1212263-59-6;ethyl 3-amino-7-oxabicyclo[2.2.1]heptane-2-carboxylate;diexo-3-Amino-7-oxa-bicyclo[2.2.1]heptane-2-carboxylic acid ethyl ester;DTXSID80588775;1932296-27-9;AB50609

Chemical Property of Ethyl 3-amino-7-oxabicyclo[2.2.1]heptane-2-carboxylate

Chemical Property:

• Boiling Point: 262.7±30.0 °C(Predicted)
• PKA: 9.26±0.40(Predicted)
• PSA: 61.55000
• Density: 1.172±0.06 g/cm3(Predicted)
• LogP: 0.75450
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 185.10519334
• Heavy Atom Count: 13
• Complexity: 219

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C1C2CCC(C1N)O2