9H-Xanthen-9-one


Chemical Name: 9H-Xanthen-9-one
CAS Number: 90-47-1
Product Number: AG0035SQ(AGN-PC-0JK7VD)
Synonyms:
MDL No:
Molecular Formula: C13H8O2
Molecular Weight: 196.2014

Identification/Properties


Properties
MP:
172-174 °C(lit.)
BP:
351.0°C
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Refractive Index:
1.6000 (estimate)
Computed Properties
Molecular Weight:
196.205g/mol
XLogP3:
3.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
196.052g/mol
Monoisotopic Mass:
196.052g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
237
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:
Danger
UN#:
2811
Hazard Statements:
H301-H315-H319
Precautionary Statements:
P301+P310-P305+P351+P338
Class:
6.1
Packing Group:

NMR Spectrum


Other Analytical Data


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