2-Naphthacenecarboxamide,4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-, (4S,4aS,5aS,6S,12aS)-


Chemical Name: 2-Naphthacenecarboxamide,4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-, (4S,4aS,5aS,6S,12aS)-
CAS Number: 60-54-8
Product Number: AG003UNG(AGN-PC-0SWIN2)
Synonyms:
MDL No:
Molecular Formula: C22H24N2O8
Molecular Weight: 444.4346

Identification/Properties


Properties
MP:
175-177 °C(lit.)
BP:
790.622°C at 760 mmHg
Storage:
Inert atmosphere;-10 ℃;
Form:
Solid
Refractive Index:
1.6500 (estimate)
Solubility:
95% ethanol: soluble12.5mg/mL
Computed Properties
Molecular Weight:
444.44g/mol
XLogP3:
-2
Hydrogen Bond Donor Count:
6
Hydrogen Bond Acceptor Count:
9
Rotatable Bond Count:
2
Exact Mass:
444.153g/mol
Monoisotopic Mass:
444.153g/mol
Topological Polar Surface Area:
182A^2
Heavy Atom Count:
32
Formal Charge:
0
Complexity:
971
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
5
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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