3-(3-chlorophenyl)-5-fluorobenzoic acid


Chemical Name: 3-(3-chlorophenyl)-5-fluorobenzoic acid
CAS Number: 1261929-09-2
Product Number: AG000S6I(AGN-PC-09O01J)
Synonyms:
MDL No:
Molecular Formula: C13H8ClFO2
Molecular Weight: 250.6528

Identification/Properties


Computed Properties
Molecular Weight:
250.653g/mol
XLogP3:
3.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
250.02g/mol
Monoisotopic Mass:
250.02g/mol
Topological Polar Surface Area:
37.3A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
285
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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