4H-1-Benzopyran-2-carboxylic acid, 6-fluoro-4-oxo-


Chemical Name: 4H-1-Benzopyran-2-carboxylic acid, 6-fluoro-4-oxo-
CAS Number: 99199-59-4
Product Number: AG003N7Q(AGN-PC-0L59AO)
Synonyms:
MDL No:
Molecular Formula: C10H5FO4
Molecular Weight: 208.1427

Identification/Properties


Properties
MP:
257-259 °C
BP:
347.5 °C at 760 mmHg
Storage:
2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
208.144g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
1
Exact Mass:
208.017g/mol
Monoisotopic Mass:
208.017g/mol
Topological Polar Surface Area:
63.6A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
336
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
Precautionary Statements:
P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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