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


Chemical Name: 2-Butenoic acid, 4-oxo-, ethyl ester, (2E)-
CAS Number: 2960-66-9
Product Number: AG002YVA(AGN-PC-0O8OMA)
Synonyms:
MDL No:
Molecular Formula: C6H8O3
Molecular Weight: 128.1259

Identification/Properties


Properties
MP:
-9°C
BP:
199.3°C at 760 mmHg
Storage:
Inert atmosphere;-10 ℃;
Form:
Liquid
Refractive Index:
1.4550
Computed Properties
Molecular Weight:
128.127g/mol
XLogP3:
0.2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
4
Exact Mass:
128.047g/mol
Monoisotopic Mass:
128.047g/mol
Topological Polar Surface Area:
43.4A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
126
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


GHS Pictogram:
Signal Word:
Danger
UN#:
2922
Hazard Statements:
H300-H314-H317
Precautionary Statements:
P280-P301+P310-P305+P351+P338-P310
Class:
8,6.1
Packing Group:

NMR Spectrum


Other Analytical Data


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