Ethanone, 1-(3-pyridinyl)-


Chemical Name: Ethanone, 1-(3-pyridinyl)-
CAS Number: 350-03-8
Product Number: AG003ITI(AGN-PC-004C4M)
Synonyms:
MDL No:
Molecular Formula: C7H7NO
Molecular Weight: 121.1366

Identification/Properties


Properties
MP:
11-13 °C(lit.)
BP:
220.8°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Liquid
Refractive Index:
n20/D 1.534(lit.)
Computed Properties
Molecular Weight:
121.139g/mol
XLogP3:
0.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
121.053g/mol
Monoisotopic Mass:
121.053g/mol
Topological Polar Surface Area:
30A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
112
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


NMR Spectrum


Other Analytical Data


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