1,3-Dioxane, 5-bromo-5-nitro-


Chemical Name: 1,3-Dioxane, 5-bromo-5-nitro-
CAS Number: 30007-47-7
Product Number: AG00I5LM(AGN-PC-0JK60J)
Synonyms:
MDL No:
Molecular Formula: C4H6BrNO4
Molecular Weight: 211.9987

Identification/Properties


Properties
MP:
60°C
BP:
280.8°C at 760 mmHg
Storage:
2-8℃;
Form:
Solid
Refractive Index:
1.6200 (estimate)
Computed Properties
Molecular Weight:
211.999g/mol
XLogP3:
0.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
0
Exact Mass:
210.948g/mol
Monoisotopic Mass:
210.948g/mol
Topological Polar Surface Area:
64.3A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
139
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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