3-Chloro-2,2-dimethyl-3-oxopropyl nitrate

Base Information

• Chemical Name: 3-Chloro-2,2-dimethyl-3-oxopropyl nitrate
• CAS No.: 104963-55-5
• Molecular Formula: C5H8ClNO4
• Molecular Weight: 181.576
• DSSTox Substance ID: DTXSID00602341
• Wikidata: Q82499344
• Mol file: 104963-55-5.mol

Synonyms:104963-55-5;3-chloro-2,2-dimethyl-3-oxopropyl nitrate;SCHEMBL4737789;DTXSID00602341;SRBNNNAAAKQFMB-UHFFFAOYSA-N;AKOS016035552;2,2-dimethyl-3-nitroxypropanoyl chloride

Chemical Property of 3-Chloro-2,2-dimethyl-3-oxopropyl nitrate

Chemical Property:

• XLogP3: 1.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 181.0141854
• Heavy Atom Count: 11
• Complexity: 174

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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