2-Butenoic acid, 3-methyl-4-oxo-, ethyl ester, (2E)-


Chemical Name: 2-Butenoic acid, 3-methyl-4-oxo-, ethyl ester, (2E)-
CAS Number: 62054-49-3
Product Number: AG0034UZ(AGN-PC-0ODLW6)
Synonyms:
MDL No:
Molecular Formula: C7H10O3
Molecular Weight: 142.1525

Identification/Properties


Properties
BP:
216.7°C at 760 mmHg
Storage:
Inert atmosphere;-10 ℃;
Form:
Liquid
Refractive Index:
n20/D 1.461
Computed Properties
Molecular Weight:
142.154g/mol
XLogP3:
0.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
4
Exact Mass:
142.063g/mol
Monoisotopic Mass:
142.063g/mol
Topological Polar Surface Area:
43.4A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
158
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
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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