2H-Pyran-2-one, 6-heptyltetrahydro-


Chemical Name: 2H-Pyran-2-one, 6-heptyltetrahydro-
CAS Number: 713-95-1
Product Number: AG003VGJ(AGN-PC-0JKATL)
Synonyms:
MDL No:
Molecular Formula: C12H22O2
Molecular Weight: 198.3019

Identification/Properties


Properties
MP:
-12?°C
BP:
295.2±8.0°C at 760mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Liquid
Refractive Index:
n20/D 1.460(lit.)
Computed Properties
Molecular Weight:
198.306g/mol
XLogP3:
3.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
6
Exact Mass:
198.162g/mol
Monoisotopic Mass:
198.162g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
166
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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