Butanenitrile, 4,4-diethoxy-


Chemical Name: Butanenitrile, 4,4-diethoxy-
CAS Number: 18381-45-8
Product Number: AG003JCG(AGN-PC-0JLWWS)
Synonyms:
MDL No:
Molecular Formula: C8H15NO2
Molecular Weight: 157.2102

Identification/Properties


Properties
BP:
104-106 °C10 mm Hg(lit.)
Storage:
Room Temperature;-10 ℃;
Refractive Index:
n20/D 1.419(lit.)
Computed Properties
Molecular Weight:
157.213g/mol
XLogP3:
0.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
6
Exact Mass:
157.11g/mol
Monoisotopic Mass:
157.11g/mol
Topological Polar Surface Area:
42.2A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
121
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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