3,5-Heptanedione, 2,6-dimethyl-


Chemical Name: 3,5-Heptanedione, 2,6-dimethyl-
CAS Number: 18362-64-6
Product Number: AG0027RW(AGN-PC-0JLWWE)
Synonyms:
MDL No:
Molecular Formula: C9H16O2
Molecular Weight: 156.2221

Identification/Properties


Properties
BP:
211.8°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Liquid
Refractive Index:
1.4575-1.4595
Computed Properties
Molecular Weight:
156.225g/mol
XLogP3:
1.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
4
Exact Mass:
156.115g/mol
Monoisotopic Mass:
156.115g/mol
Topological Polar Surface Area:
34.1A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
139
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:
Danger
UN#:
1224
Hazard Statements:
H226-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
3
Packing Group:

NMR Spectrum


Other Analytical Data


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