2-Propenoic acid, 3-(2-chloro-4-fluorophenyl)-


Chemical Name: 2-Propenoic acid, 3-(2-chloro-4-fluorophenyl)-
CAS Number: 133220-86-7
Product Number: AG0014F8(AGN-PC-0KK0KH)
Synonyms:
MDL No:
Molecular Formula: C9H6ClFO2
Molecular Weight: 200.5941

Identification/Properties


Properties
MP:
245-247 °C
BP:
253.592°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
200.593g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
200.004g/mol
Monoisotopic Mass:
200.004g/mol
Topological Polar Surface Area:
37.3A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
218
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:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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