3,5-Heptanedione, 2,2,6,6-tetramethyl-


Chemical Name: 3,5-Heptanedione, 2,2,6,6-tetramethyl-
CAS Number: 1118-71-4
Product Number: AG0032WE(AGN-PC-0JL9VE)
Synonyms:
MDL No:
Molecular Formula: C11H20O2
Molecular Weight: 184.2753

Identification/Properties


Properties
BP:
72-73°C at 6 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Refractive Index:
n20/D 1.459(lit.)
Solubility:
Difficult to mix.
Computed Properties
Molecular Weight:
184.279g/mol
XLogP3:
2.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
4
Exact Mass:
184.146g/mol
Monoisotopic Mass:
184.146g/mol
Topological Polar Surface Area:
34.1A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
189
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:
H302
Precautionary Statements:
P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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