Dimethyl 2-nitropentanedioate

Base Information

• Chemical Name: Dimethyl 2-nitropentanedioate
• CAS No.: 28081-33-6
• Molecular Formula: C7H11NO6
• Molecular Weight: 205.167
• DSSTox Substance ID: DTXSID70542548
• Nikkaji Number: J576.909D
• Mol file: 28081-33-6.mol

Synonyms:dimethyl 2-nitropentanedioate;28081-33-6;dimethyl-2-nitroglutarate;DTXSID70542548;2-nitro-pentanedioic acid dimethyl ester

Chemical Property of Dimethyl 2-nitropentanedioate

Chemical Property:

• XLogP3: 0.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 6
• Exact Mass: 205.05863707
• Heavy Atom Count: 14
• Complexity: 233

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)CCC(C(=O)OC)[N+](=O)[O-]