Ethyl 2-nitropentanoate

Base Information

• Chemical Name: Ethyl 2-nitropentanoate
• CAS No.: 2531-82-0
• Molecular Formula: C₇H₁₃NO₄
• Molecular Weight: 175.185
• DSSTox Substance ID: DTXSID701287250
• Mol file: 2531-82-0.mol

Synonyms:Ethyl 2-nitropentanoate;Pentanoic acid, 2-nitro-, ethyl ester;ethylalpha-nitrovalerate;2531-82-0;SCHEMBL17674236;DTXSID701287250;AKOS024340633

Chemical Property of Ethyl 2-nitropentanoate

Chemical Property:

• XLogP3: 1.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 175.08445790
• Heavy Atom Count: 12
• Complexity: 163

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC(C(=O)OCC)[N+](=O)[O-]