5-amino-3',6'-dihydroxyspiro[2-benzofuran-3,9'-xanthene]-1-one


Chemical Name: 5-amino-3',6'-dihydroxyspiro[2-benzofuran-3,9'-xanthene]-1-one
CAS Number: 51649-83-3
Product Number: AG006UF7(AGN-PC-0JLE0S)
Synonyms:
MDL No: MFCD00005051
Molecular Formula: C20H13NO5
Molecular Weight: 347.3209

Identification/Properties


Properties
MP:
285 °C (dec.)(lit.)
BP:
706.65 °C at 760 mmHg
Storage:
-10 ℃;
Form:
Solid
Refractive Index:
1.5180 (estimate)
Solubility:
methanol: soluble1mg/mL, clear, yellow to very dark yellow-orange
Computed Properties
Molecular Weight:
347.326g/mol
XLogP3:
2.7
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
0
Exact Mass:
347.079g/mol
Monoisotopic Mass:
347.079g/mol
Topological Polar Surface Area:
102A^2
Heavy Atom Count:
26
Formal Charge:
0
Complexity:
557
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


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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