Butanoic acid, 4,4,4-trifluoro-3-oxo-, ethyl ester


Chemical Name: Butanoic acid, 4,4,4-trifluoro-3-oxo-, ethyl ester
CAS Number: 372-31-6
Product Number: AG0035YJ(AGN-PC-0JL81O)
Synonyms:
MDL No:
Molecular Formula: C6H7F3O3
Molecular Weight: 184.1132

Identification/Properties


Properties
MP:
-39 °C
BP:
133.0°C
Storage:
Keep in dry area;Room Temperature;
Form:
Liquid
Refractive Index:
n20/D 1.375(lit.)
Solubility:
10g/l
Computed Properties
Molecular Weight:
184.114g/mol
XLogP3:
1.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
4
Exact Mass:
184.035g/mol
Monoisotopic Mass:
184.035g/mol
Topological Polar Surface Area:
43.4A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
185
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:
H226-H302-H412
Precautionary Statements:
P273
Class:
3
Packing Group:

NMR Spectrum


Other Analytical Data


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