2-Butenoic acid, ethenyl ester


Chemical Name: 2-Butenoic acid, ethenyl ester
CAS Number: 14861-06-4
Product Number: AG001L2N(AGN-PC-0JL4O1)
Synonyms:
MDL No:
Molecular Formula: C6H8O2
Molecular Weight: 112.1265

Identification/Properties


Properties
MP:
-60℃
BP:
133-134 °C(lit.)
Storage:
2-8℃;
Form:
Liquid
Refractive Index:
n20/D 1.448(lit.)
Computed Properties
Molecular Weight:
112.128g/mol
XLogP3:
1.4
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:
114
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#:
3272
Hazard Statements:
H226-H315-H319-H335
Precautionary Statements:
P210-P233-P240-P241-P242-P243-P260-P261-P264-P271-P280-P302+P352-P303+P361+P353-P304-P304+P340-P305+P351+P338-P312-P321-P332+P313-P337+P313-P340-P362-P370+P378-P403-P403+P233-P403+P235-P405-P501
Class:
3
Packing Group:

NMR Spectrum


Other Analytical Data


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