2-Nitro-3-pivaloyloxypropene

Base Information

• Chemical Name: 2-Nitro-3-pivaloyloxypropene
• CAS No.: 78551-14-1
• Molecular Formula: C8H13NO4
• Molecular Weight: 187.196
• DSSTox Substance ID: DTXSID80474306
• Nikkaji Number: J1.017.720K
• Wikidata: Q82304228

Synonyms:78551-14-1;2-NITRO-3-PIVALOYLOXYPROPENE;DTXSID80474306

Chemical Property of 2-Nitro-3-pivaloyloxypropene

Chemical Property:

• XLogP3: 1.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 187.08445790
• Heavy Atom Count: 13
• Complexity: 234

Purity/Quality:

99% ^*data from raw suppliers

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MSDS Files:

SDS file from LookChem

Useful:

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

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