4-(3-carboxy-5-fluorophenyl)-2-chlorobenzoic acid


Chemical Name: 4-(3-carboxy-5-fluorophenyl)-2-chlorobenzoic acid
CAS Number: 1261906-07-3
Product Number: AG000S5H(AGN-PC-09O139)
Synonyms:
MDL No:
Molecular Formula: C14H8ClFO4
Molecular Weight: 294.6623

Identification/Properties


Computed Properties
Molecular Weight:
294.662g/mol
XLogP3:
3.3
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
3
Exact Mass:
294.01g/mol
Monoisotopic Mass:
294.01g/mol
Topological Polar Surface Area:
74.6A^2
Heavy Atom Count:
20
Formal Charge:
0
Complexity:
389
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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