Home Carboxys 7-fluoro-4-methyl-2-oxo-2H-chromene-3-carboxylic acid

7-fluoro-4-methyl-2-oxo-2H-chromene-3-carboxylic acid

CAS No.:
536741-68-1
Catalog Number:
AG019ZPH
Molecular Formula:
C11H7FO4
Molecular Weight:
222.1693
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Product Description
Catalog Number:
AG019ZPH
Chemical Name:
7-fluoro-4-methyl-2-oxo-2H-chromene-3-carboxylic acid
CAS Number:
536741-68-1
Molecular Formula:
C11H7FO4
Molecular Weight:
222.1693
MDL Number:
MFCD22375295
IUPAC Name:
7-fluoro-4-methyl-2-oxochromene-3-carboxylic acid
InChI:
InChI=1S/C11H7FO4/c1-5-7-3-2-6(12)4-8(7)16-11(15)9(5)10(13)14/h2-4H,1H3,(H,13,14)
InChI Key:
VGRKTBCYYSNKBO-UHFFFAOYSA-N
SMILES:
Fc1ccc2c(c1)oc(=O)c(c2C)C(=O)O
Properties
Complexity:
374  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.033g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
222.171g/mol
Monoisotopic Mass:
222.033g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties