4,7,10,13-Tetraoxahexadeca-1,15-diyne


Chemical Name: 4,7,10,13-Tetraoxahexadeca-1,15-diyne
CAS Number: 126422-58-0
Product Number: AG000SRZ(AGN-PC-00IO1E)
Synonyms:
MDL No:
Molecular Formula: C12H18O4
Molecular Weight: 226.2689

Identification/Properties


Computed Properties
Molecular Weight:
226.272g/mol
XLogP3:
-0.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
11
Exact Mass:
226.121g/mol
Monoisotopic Mass:
226.121g/mol
Topological Polar Surface Area:
36.9A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
206
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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