2-(1-Aziridinyl)-3-benzyl-5-ethyl-5-nitrotetrahydro-2H-1,3,2-oxazaphosphorine 2-oxide

Base Information

• Chemical Name: 2-(1-Aziridinyl)-3-benzyl-5-ethyl-5-nitrotetrahydro-2H-1,3,2-oxazaphosphorine 2-oxide
• CAS No.: 52855-16-0
• Molecular Formula: C14H20N3O4P
• Molecular Weight: 325.3001
• DSSTox Substance ID: DTXSID60967322
• Mol file: 52855-16-0.mol

Synonyms:OK-5;2-(1-Aziridinyl)-3-benzyl-5-ethyl-5-nitrotetrahydro-2H-1,3,2-oxazaphosphorine 2-oxide;2H-1,3,2-Oxazaphosphorine, tetrahydro-2-(1-aziridinyl)-3-benzyl-5-ethyl-5-nitro-, 2-oxide;52855-16-0;C14H20N3O4P;DTXSID60967322;C14-H20-N3-O4-P;LS-99833;2-(Aziridin-1-yl)-3-benzyl-5-ethyl-5-nitro-1,3,2lambda~5~-oxazaphosphinan-2-one

Chemical Property of 2-(1-Aziridinyl)-3-benzyl-5-ethyl-5-nitrotetrahydro-2H-1,3,2-oxazaphosphorine 2-oxide

Chemical Property:

• Vapor Pressure: 1.58E-08mmHg at 25°C
• Boiling Point: 456.7°C at 760 mmHg
• Flash Point: 230°C
• Density: 1.34g/cm³
• XLogP3: 1.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 4
• Exact Mass: 325.11914313
• Heavy Atom Count: 22
• Complexity: 473

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC1(CN(P(=O)(OC1)N2CC2)CC3=CC=CC=C3)[N+](=O)[O-]