1(3H)-Isobenzofuranone, 3,3-bis(4-hydroxyphenyl)-


Chemical Name: 1(3H)-Isobenzofuranone, 3,3-bis(4-hydroxyphenyl)-
CAS Number: 77-09-8
Product Number: AG003TOB(AGN-PC-0JK704)
Synonyms:
MDL No:
Molecular Formula: C20H14O4
Molecular Weight: 318.3228

Identification/Properties


Properties
MP:
258-263 °C
BP:
417.49°C (rough estimate)
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Refractive Index:
1.5400 (estimate)
Solubility:
Soluble in alcohol. Slightly soluble in ether. Slightly soluble in dimethyl sulfoxide and insoluble in benzene or hexane.
Computed Properties
Molecular Weight:
318.328g/mol
XLogP3:
3.6
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
318.089g/mol
Monoisotopic Mass:
318.089g/mol
Topological Polar Surface Area:
66.8A^2
Heavy Atom Count:
24
Formal Charge:
0
Complexity:
438
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#:
3077
Hazard Statements:
H302-H340-H350-H361-H411
Precautionary Statements:
P201-P273-P281-P308+P313
Class:
9
Packing Group:

NMR Spectrum


Other Analytical Data


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