2,3-Butadienoic acid, ethyl ester


Chemical Name: 2,3-Butadienoic acid, ethyl ester
CAS Number: 14369-81-4
Product Number: AG001I6U(AGN-PC-0L4QFG)
Synonyms:
MDL No:
Molecular Formula: C6H8O2
Molecular Weight: 112.1265

Identification/Properties


Properties
BP:
80 °C60 mm Hg(lit.)
Storage:
-10 ℃;Keep in dry area;
Form:
Liquid
Refractive Index:
n20/D 1.46(lit.)
Computed Properties
Molecular Weight:
112.128g/mol
XLogP3:
0.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
3
Exact Mass:
112.052g/mol
Monoisotopic Mass:
112.052g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
8
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:
No

Safety Information


NMR Spectrum


Other Analytical Data


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