2,5-Cyclohexadiene-1,4-dione, 2,6-dimethyl-


Chemical Name: 2,5-Cyclohexadiene-1,4-dione, 2,6-dimethyl-
CAS Number: 527-61-7
Product Number: AG003G5M(AGN-PC-0JL8CG)
Synonyms:
MDL No:
Molecular Formula: C8H8O2
Molecular Weight: 136.1479

Identification/Properties


Properties
MP:
71-73 °C(lit.)
BP:
200.9°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Refractive Index:
1.
Computed Properties
Molecular Weight:
136.15g/mol
XLogP3:
1.2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
136.052g/mol
Monoisotopic Mass:
136.052g/mol
Topological Polar Surface Area:
34.1A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
232
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-H332-H335
Precautionary Statements:
P233-P260-P261-P264-P270-P271-P280-P301+P312-P302+P352-P304-P304+P340-P305+P351+P338-P312-P321-P330-P332+P313-P337+P313-P340-P362-P403-P403+P233-P405-P501
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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