3,5-Heptanedione, 2,2,6,6-tetramethyl-, ion(1-), barium


Chemical Name: 3,5-Heptanedione, 2,2,6,6-tetramethyl-, ion(1-), barium
CAS Number: 17594-47-7
Product Number: AG003NYS(AGN-PC-0QAVCB)
Synonyms:
MDL No:
Molecular Formula:
Molecular Weight:

Identification/Properties


Properties
MP:
175-185℃
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
503.869g/mol
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
8
Exact Mass:
504.182g/mol
Monoisotopic Mass:
504.182g/mol
Topological Polar Surface Area:
80.3A^2
Heavy Atom Count:
27
Formal Charge:
0
Complexity:
505
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
3
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Danger
UN#:
1564
Hazard Statements:
H301-H311-H315-H319-H331-H335
Precautionary Statements:
P261-P280-P301+P310-P305+P351+P338-P311
Class:
6.1
Packing Group:

NMR Spectrum


Other Analytical Data


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