D-Glucitol, 1,4:3,6-dianhydro-, 5-nitrate


Chemical Name: D-Glucitol, 1,4:3,6-dianhydro-, 5-nitrate
CAS Number: 16051-77-7
Product Number: AG00352D(AGN-PC-0Q7W8L)
Synonyms:
MDL No:
Molecular Formula: C6H9NO6
Molecular Weight: 191.1388

Identification/Properties


Properties
MP:
88-93 °C
BP:
326.86°C (rough estimate)
Storage:
-10 ℃;
Form:
Solid
Refractive Index:
145 ° (C=5, H2O)
Computed Properties
Molecular Weight:
191.139g/mol
XLogP3:
-0.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
1
Exact Mass:
191.043g/mol
Monoisotopic Mass:
191.043g/mol
Topological Polar Surface Area:
93.7A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
216
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
4
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


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