2,5-Cyclohexadiene-1,4-dione, 2,5-bis(1,1-dimethylethyl)-


Chemical Name: 2,5-Cyclohexadiene-1,4-dione, 2,5-bis(1,1-dimethylethyl)-
CAS Number: 2460-77-7
Product Number: AG002OPM(AGN-PC-0JKDAT)
Synonyms:
MDL No:
Molecular Formula: C14H20O2
Molecular Weight: 220.3074

Identification/Properties


Properties
MP:
152-154°C(lit.)
BP:
285.4°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Refractive Index:
1.4970 (estimate)
Computed Properties
Molecular Weight:
220.312g/mol
XLogP3:
3.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
2
Exact Mass:
220.146g/mol
Monoisotopic Mass:
220.146g/mol
Topological Polar Surface Area:
34.1A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
355
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#:
N/A
Hazard Statements:
H315-H319
Precautionary Statements:
P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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