Ethanone, 1-(2,3,6-trifluorophenyl)-


Chemical Name: Ethanone, 1-(2,3,6-trifluorophenyl)-
CAS Number: 208173-22-2
Product Number: AG002JJP(AGN-PC-0JTH0G)
Synonyms:
MDL No: MFCD00070809
Molecular Formula: C8H5F3O
Molecular Weight: 174.1199

Identification/Properties


Properties
Storage:
Room Temperature;
Form:
Liquid
Refractive Index:
1.467
Computed Properties
Molecular Weight:
174.122g/mol
XLogP3:
1.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
174.029g/mol
Monoisotopic Mass:
174.029g/mol
Topological Polar Surface Area:
17.1A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
183
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:
Warning
UN#:
-
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P233-P260-P261-P264-P271-P280-P302+P352-P304-P304+P340-P305+P351+P338-P312-P321-P332+P313-P337+P313-P340-P362-P403-P403+P233-P405-P501
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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