1(3H)-Isobenzofuranone, 3,3-dimethyl-


Chemical Name: 1(3H)-Isobenzofuranone, 3,3-dimethyl-
CAS Number: 1689-09-4
Product Number: AG001YD7(AGN-PC-0JLBJA)
Synonyms:
MDL No:
Molecular Formula: C10H10O2
Molecular Weight: 162.1852

Identification/Properties


Properties
MP:
68℃
BP:
291.1°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
162.188g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
162.068g/mol
Monoisotopic Mass:
162.068g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
208
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:
H302-H315-H319-H335
Precautionary Statements:
P261-P280-P301+P312-P302+P352-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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