Ethanone, 1-(3-chloro-4-fluorophenyl)-


Chemical Name: Ethanone, 1-(3-chloro-4-fluorophenyl)-
CAS Number: 2923-66-2
Product Number: AG002XT5(AGN-PC-0JS9GX)
Synonyms:
MDL No:
Molecular Formula: C8H6ClFO
Molecular Weight: 172.5840

Identification/Properties


Properties
MP:
42 °C
BP:
252.45 °C at 760 mmHg
Storage:
Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
172.583g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
172.009g/mol
Monoisotopic Mass:
172.009g/mol
Topological Polar Surface Area:
17.1A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
160
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#:
N/A
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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