1,3-Isobenzofurandione, hexahydro-


Chemical Name: 1,3-Isobenzofurandione, hexahydro-
CAS Number: 85-42-7
Product Number: AG003281(AGN-PC-0C2KFB)
Synonyms:
MDL No:
Molecular Formula: C8H10O3
Molecular Weight: 154.1632

Identification/Properties


Properties
MP:
32-34 °C(lit.)
BP:
158°C at 17 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Stability:
Moisture Sensitive
Refractive Index:
1.4620 (estimate)
Computed Properties
Molecular Weight:
154.165g/mol
XLogP3:
1.2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
154.063g/mol
Monoisotopic Mass:
154.063g/mol
Topological Polar Surface Area:
43.4A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
187
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
2
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-H317-H319-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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