2-Propenoic acid, trifluoroethyl ester


Chemical Name: 2-Propenoic acid, trifluoroethyl ester
CAS Number: 407-47-6
Product Number: AG003F75(AGN-PC-0JL842)
Synonyms:
MDL No:
Molecular Formula: C5H5F3O2
Molecular Weight: 154.0872096

Identification/Properties


Properties
BP:
46 °C125 mm Hg(lit.)
Storage:
2-8℃;Light sensitive;Keep in dry area;
Form:
Liquid
Refractive Index:
n20/D 1.35(lit.)
Computed Properties
Molecular Weight:
154.088g/mol
XLogP3:
2.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
3
Exact Mass:
154.024g/mol
Monoisotopic Mass:
154.024g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
138
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


GHS Pictogram:
Signal Word:
Danger
UN#:
3272
Hazard Statements:
H225-H302+H312+H332-H315-H319-H335
Precautionary Statements:
P210-P261-P280-P305+P351+P338
Class:
3
Packing Group:

NMR Spectrum


Other Analytical Data


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